Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:58:38 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./ZnF2.save/ file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized file Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 55 34 10 1239 613 104 Max 56 35 11 1240 627 107 Sum 2001 1257 377 44625 22323 3783 bravais-lattice index = 14 lattice parameter (alat) = 8.8908 a.u. unit-cell volume = 468.1124 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 317.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.890783 celldm(2)= 1.000000 celldm(3)= 0.666086 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 0.666086 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 1.501308 ) PseudoPot. # 1 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Zn read from file: /users/gautes/Pseudo/Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8d14e5a70806ad8c3d477ea097862760 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1201 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential F 7.00 18.99840 F( 1.00) Zn 12.00 65.40900 Zn( 1.00) 16 Sym. Ops., with inversion, found ( 8 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3330428 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3330428 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.3330428 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.3330428 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(10) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.3330428 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.3330428 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3330428 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3330428 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [0,0,-1] -2C4 -7 -8 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2'-2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2C2''-2C2' 5 -5 6 -6 180 deg rotation - cart. axis [1,1,0] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [0,0,-1] E s_h -s_h 10 -10 inv. 180 deg rotation - cart. axis [0,0,1] 2s_v-2s_v 11 -11 12 -12 inv. 180 deg rotation - cart. axis [0,1,0] 2s_d-2s_d 13 -13 14 -14 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 394 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 2) = ( 0.0000000 0.0147059 -0.0000000), wk = 0.0025381 k( 3) = ( 0.0000000 0.0294118 -0.0000000), wk = 0.0025381 k( 4) = ( 0.0000000 0.0441177 -0.0000000), wk = 0.0025381 k( 5) = ( 0.0000000 0.0588235 -0.0000000), wk = 0.0025381 k( 6) = ( 0.0000000 0.0735294 -0.0000000), wk = 0.0025381 k( 7) = ( 0.0000000 0.0882353 -0.0000000), wk = 0.0025381 k( 8) = ( 0.0000000 0.1029412 -0.0000000), wk = 0.0025381 k( 9) = ( 0.0000000 0.1176471 -0.0000000), wk = 0.0025381 k( 10) = ( 0.0000000 0.1323529 -0.0000000), wk = 0.0025381 k( 11) = ( 0.0000000 0.1470588 -0.0000000), wk = 0.0025381 k( 12) = ( 0.0000000 0.1617647 -0.0000000), wk = 0.0025381 k( 13) = ( 0.0000000 0.1764706 -0.0000000), wk = 0.0025381 k( 14) = ( 0.0000000 0.1911765 -0.0000000), wk = 0.0025381 k( 15) = ( 0.0000000 0.2058823 -0.0000000), wk = 0.0025381 k( 16) = ( 0.0000000 0.2205882 -0.0000000), wk = 0.0025381 k( 17) = ( 0.0000000 0.2352941 -0.0000000), wk = 0.0025381 k( 18) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0025381 k( 19) = ( 0.0000000 0.2647059 -0.0000000), wk = 0.0025381 k( 20) = ( 0.0000000 0.2794118 -0.0000000), wk = 0.0025381 k( 21) = ( 0.0000000 0.2941177 -0.0000000), wk = 0.0025381 k( 22) = ( 0.0000000 0.3088235 -0.0000000), wk = 0.0025381 k( 23) = ( 0.0000000 0.3235294 -0.0000000), wk = 0.0025381 k( 24) = ( 0.0000000 0.3382353 -0.0000000), wk = 0.0025381 k( 25) = ( 0.0000000 0.3529412 -0.0000000), wk = 0.0025381 k( 26) = ( 0.0000000 0.3676471 -0.0000000), wk = 0.0025381 k( 27) = ( 0.0000000 0.3823529 -0.0000000), wk = 0.0025381 k( 28) = ( 0.0000000 0.3970588 -0.0000000), wk = 0.0025381 k( 29) = ( 0.0000000 0.4117647 -0.0000000), wk = 0.0025381 k( 30) = ( 0.0000000 0.4264706 -0.0000000), wk = 0.0025381 k( 31) = ( 0.0000000 0.4411765 -0.0000000), wk = 0.0025381 k( 32) = ( 0.0000000 0.4558823 -0.0000000), wk = 0.0025381 k( 33) = ( 0.0000000 0.4705882 -0.0000000), wk = 0.0025381 k( 34) = ( 0.0000000 0.4852941 -0.0000000), wk = 0.0025381 k( 35) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025381 k( 36) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025381 k( 37) = ( 0.0147059 0.5000000 -0.0000000), wk = 0.0025381 k( 38) = ( 0.0294118 0.5000000 -0.0000000), wk = 0.0025381 k( 39) = ( 0.0441177 0.5000000 -0.0000000), wk = 0.0025381 k( 40) = ( 0.0588235 0.5000000 -0.0000000), wk = 0.0025381 k( 41) = ( 0.0735294 0.5000000 -0.0000000), wk = 0.0025381 k( 42) = ( 0.0882353 0.5000000 -0.0000000), wk = 0.0025381 k( 43) = ( 0.1029412 0.5000000 -0.0000000), wk = 0.0025381 k( 44) = ( 0.1176471 0.5000000 -0.0000000), wk = 0.0025381 k( 45) = ( 0.1323529 0.5000000 -0.0000000), wk = 0.0025381 k( 46) = ( 0.1470588 0.5000000 -0.0000000), wk = 0.0025381 k( 47) = ( 0.1617647 0.5000000 -0.0000000), wk = 0.0025381 k( 48) = ( 0.1764706 0.5000000 -0.0000000), wk = 0.0025381 k( 49) = ( 0.1911765 0.5000000 -0.0000000), wk = 0.0025381 k( 50) = ( 0.2058823 0.5000000 -0.0000000), wk = 0.0025381 k( 51) = ( 0.2205882 0.5000000 -0.0000000), wk = 0.0025381 k( 52) = ( 0.2352941 0.5000000 -0.0000000), wk = 0.0025381 k( 53) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0025381 k( 54) = ( 0.2647059 0.5000000 -0.0000000), wk = 0.0025381 k( 55) = ( 0.2794118 0.5000000 -0.0000000), wk = 0.0025381 k( 56) = ( 0.2941177 0.5000000 -0.0000000), wk = 0.0025381 k( 57) = ( 0.3088235 0.5000000 -0.0000000), wk = 0.0025381 k( 58) = ( 0.3235294 0.5000000 -0.0000000), wk = 0.0025381 k( 59) = ( 0.3382353 0.5000000 -0.0000000), wk = 0.0025381 k( 60) = ( 0.3529412 0.5000000 -0.0000000), wk = 0.0025381 k( 61) = ( 0.3676471 0.5000000 -0.0000000), wk = 0.0025381 k( 62) = ( 0.3823529 0.5000000 -0.0000000), wk = 0.0025381 k( 63) = ( 0.3970588 0.5000000 -0.0000000), wk = 0.0025381 k( 64) = ( 0.4117647 0.5000000 -0.0000000), wk = 0.0025381 k( 65) = ( 0.4264706 0.5000000 -0.0000000), wk = 0.0025381 k( 66) = ( 0.4411765 0.5000000 -0.0000000), wk = 0.0025381 k( 67) = ( 0.4558823 0.5000000 -0.0000000), wk = 0.0025381 k( 68) = ( 0.4705882 0.5000000 -0.0000000), wk = 0.0025381 k( 69) = ( 0.4852941 0.5000000 -0.0000000), wk = 0.0025381 k( 70) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025381 k( 71) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025381 k( 72) = ( 0.4895833 0.4895833 -0.0000000), wk = 0.0025381 k( 73) = ( 0.4791667 0.4791667 -0.0000000), wk = 0.0025381 k( 74) = ( 0.4687500 0.4687500 -0.0000000), wk = 0.0025381 k( 75) = ( 0.4583333 0.4583333 -0.0000000), wk = 0.0025381 k( 76) = ( 0.4479167 0.4479167 -0.0000000), wk = 0.0025381 k( 77) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0025381 k( 78) = ( 0.4270833 0.4270833 -0.0000000), wk = 0.0025381 k( 79) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0025381 k( 80) = ( 0.4062500 0.4062500 -0.0000000), wk = 0.0025381 k( 81) = ( 0.3958333 0.3958333 -0.0000000), wk = 0.0025381 k( 82) = ( 0.3854167 0.3854167 -0.0000000), wk = 0.0025381 k( 83) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0025381 k( 84) = ( 0.3645833 0.3645833 -0.0000000), wk = 0.0025381 k( 85) = ( 0.3541667 0.3541667 -0.0000000), wk = 0.0025381 k( 86) = ( 0.3437500 0.3437500 -0.0000000), wk = 0.0025381 k( 87) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0025381 k( 88) = ( 0.3229167 0.3229167 -0.0000000), wk = 0.0025381 k( 89) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0025381 k( 90) = ( 0.3020833 0.3020833 -0.0000000), wk = 0.0025381 k( 91) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0025381 k( 92) = ( 0.2812500 0.2812500 -0.0000000), wk = 0.0025381 k( 93) = ( 0.2708333 0.2708333 -0.0000000), wk = 0.0025381 k( 94) = ( 0.2604167 0.2604167 -0.0000000), wk = 0.0025381 k( 95) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0025381 k( 96) = ( 0.2395833 0.2395833 -0.0000000), wk = 0.0025381 k( 97) = ( 0.2291667 0.2291667 -0.0000000), wk = 0.0025381 k( 98) = ( 0.2187500 0.2187500 -0.0000000), wk = 0.0025381 k( 99) = ( 0.2083333 0.2083333 -0.0000000), wk = 0.0025381 k( 100) = ( 0.1979167 0.1979167 -0.0000000), wk = 0.0025381 k( 101) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0025381 k( 102) = ( 0.1770833 0.1770833 -0.0000000), wk = 0.0025381 k( 103) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0025381 k( 104) = ( 0.1562500 0.1562500 -0.0000000), wk = 0.0025381 k( 105) = ( 0.1458333 0.1458333 -0.0000000), wk = 0.0025381 k( 106) = ( 0.1354167 0.1354167 -0.0000000), wk = 0.0025381 k( 107) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0025381 k( 108) = ( 0.1145833 0.1145833 -0.0000000), wk = 0.0025381 k( 109) = ( 0.1041667 0.1041667 -0.0000000), wk = 0.0025381 k( 110) = ( 0.0937500 0.0937500 -0.0000000), wk = 0.0025381 k( 111) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0025381 k( 112) = ( 0.0729167 0.0729167 -0.0000000), wk = 0.0025381 k( 113) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0025381 k( 114) = ( 0.0520833 0.0520833 -0.0000000), wk = 0.0025381 k( 115) = ( 0.0416667 0.0416667 -0.0000000), wk = 0.0025381 k( 116) = ( 0.0312500 0.0312500 -0.0000000), wk = 0.0025381 k( 117) = ( 0.0208333 0.0208333 -0.0000000), wk = 0.0025381 k( 118) = ( 0.0104167 0.0104167 -0.0000000), wk = 0.0025381 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 121) = ( 0.0000000 0.0000000 0.0147187), wk = 0.0025381 k( 122) = ( 0.0000000 0.0000000 0.0294374), wk = 0.0025381 k( 123) = ( 0.0000000 0.0000000 0.0441561), wk = 0.0025381 k( 124) = ( 0.0000000 0.0000000 0.0588748), wk = 0.0025381 k( 125) = ( 0.0000000 0.0000000 0.0735935), wk = 0.0025381 k( 126) = ( 0.0000000 0.0000000 0.0883123), wk = 0.0025381 k( 127) = ( 0.0000000 0.0000000 0.1030310), wk = 0.0025381 k( 128) = ( 0.0000000 0.0000000 0.1177497), wk = 0.0025381 k( 129) = ( 0.0000000 0.0000000 0.1324684), wk = 0.0025381 k( 130) = ( 0.0000000 0.0000000 0.1471871), wk = 0.0025381 k( 131) = ( 0.0000000 0.0000000 0.1619058), wk = 0.0025381 k( 132) = ( 0.0000000 0.0000000 0.1766245), wk = 0.0025381 k( 133) = ( 0.0000000 0.0000000 0.1913432), wk = 0.0025381 k( 134) = ( 0.0000000 0.0000000 0.2060619), wk = 0.0025381 k( 135) = ( 0.0000000 0.0000000 0.2207806), wk = 0.0025381 k( 136) = ( 0.0000000 0.0000000 0.2354994), wk = 0.0025381 k( 137) = ( 0.0000000 0.0000000 0.2502181), wk = 0.0025381 k( 138) = ( 0.0000000 0.0000000 0.2649368), wk = 0.0025381 k( 139) = ( 0.0000000 0.0000000 0.2796555), wk = 0.0025381 k( 140) = ( 0.0000000 0.0000000 0.2943742), wk = 0.0025381 k( 141) = ( 0.0000000 0.0000000 0.3090929), wk = 0.0025381 k( 142) = ( 0.0000000 0.0000000 0.3238116), wk = 0.0025381 k( 143) = ( 0.0000000 0.0000000 0.3385303), wk = 0.0025381 k( 144) = ( 0.0000000 0.0000000 0.3532490), wk = 0.0025381 k( 145) = ( 0.0000000 0.0000000 0.3679677), wk = 0.0025381 k( 146) = ( 0.0000000 0.0000000 0.3826864), wk = 0.0025381 k( 147) = ( 0.0000000 0.0000000 0.3974051), wk = 0.0025381 k( 148) = ( 0.0000000 0.0000000 0.4121238), wk = 0.0025381 k( 149) = ( 0.0000000 0.0000000 0.4268426), wk = 0.0025381 k( 150) = ( 0.0000000 0.0000000 0.4415613), wk = 0.0025381 k( 151) = ( 0.0000000 0.0000000 0.4562800), wk = 0.0025381 k( 152) = ( 0.0000000 0.0000000 0.4709987), wk = 0.0025381 k( 153) = ( 0.0000000 0.0000000 0.4857174), wk = 0.0025381 k( 154) = ( 0.0000000 0.0000000 0.5004361), wk = 0.0025381 k( 155) = ( 0.0000000 0.0000000 0.5151548), wk = 0.0025381 k( 156) = ( 0.0000000 0.0000000 0.5298735), wk = 0.0025381 k( 157) = ( 0.0000000 0.0000000 0.5445922), wk = 0.0025381 k( 158) = ( 0.0000000 0.0000000 0.5593109), wk = 0.0025381 k( 159) = ( 0.0000000 0.0000000 0.5740296), wk = 0.0025381 k( 160) = ( 0.0000000 0.0000000 0.5887484), wk = 0.0025381 k( 161) = ( 0.0000000 0.0000000 0.6034671), wk = 0.0025381 k( 162) = ( 0.0000000 0.0000000 0.6181858), wk = 0.0025381 k( 163) = ( 0.0000000 0.0000000 0.6329045), wk = 0.0025381 k( 164) = ( 0.0000000 0.0000000 0.6476232), wk = 0.0025381 k( 165) = ( 0.0000000 0.0000000 0.6623419), wk = 0.0025381 k( 166) = ( 0.0000000 0.0000000 0.6770606), wk = 0.0025381 k( 167) = ( 0.0000000 0.0000000 0.6917793), wk = 0.0025381 k( 168) = ( 0.0000000 0.0000000 0.7064980), wk = 0.0025381 k( 169) = ( 0.0000000 0.0000000 0.7212167), wk = 0.0025381 k( 170) = ( 0.0000000 0.0000000 0.7359355), wk = 0.0025381 k( 171) = ( 0.0000000 0.0000000 0.7506542), wk = 0.0025381 k( 172) = ( 0.0000000 0.0000000 0.7506542), wk = 0.0025381 k( 173) = ( 0.0000000 0.0147059 0.7506542), wk = 0.0025381 k( 174) = ( 0.0000000 0.0294118 0.7506542), wk = 0.0025381 k( 175) = ( 0.0000000 0.0441177 0.7506542), wk = 0.0025381 k( 176) = ( 0.0000000 0.0588235 0.7506542), wk = 0.0025381 k( 177) = ( 0.0000000 0.0735294 0.7506542), wk = 0.0025381 k( 178) = ( 0.0000000 0.0882353 0.7506542), wk = 0.0025381 k( 179) = ( 0.0000000 0.1029412 0.7506542), wk = 0.0025381 k( 180) = ( 0.0000000 0.1176471 0.7506542), wk = 0.0025381 k( 181) = ( 0.0000000 0.1323529 0.7506542), wk = 0.0025381 k( 182) = ( 0.0000000 0.1470588 0.7506542), wk = 0.0025381 k( 183) = ( 0.0000000 0.1617647 0.7506542), wk = 0.0025381 k( 184) = ( 0.0000000 0.1764706 0.7506542), wk = 0.0025381 k( 185) = ( 0.0000000 0.1911765 0.7506542), wk = 0.0025381 k( 186) = ( 0.0000000 0.2058823 0.7506542), wk = 0.0025381 k( 187) = ( 0.0000000 0.2205882 0.7506542), wk = 0.0025381 k( 188) = ( 0.0000000 0.2352941 0.7506542), wk = 0.0025381 k( 189) = ( 0.0000000 0.2500000 0.7506542), wk = 0.0025381 k( 190) = ( 0.0000000 0.2647059 0.7506542), wk = 0.0025381 k( 191) = ( 0.0000000 0.2794118 0.7506542), wk = 0.0025381 k( 192) = ( 0.0000000 0.2941177 0.7506542), wk = 0.0025381 k( 193) = ( 0.0000000 0.3088235 0.7506542), wk = 0.0025381 k( 194) = ( 0.0000000 0.3235294 0.7506542), wk = 0.0025381 k( 195) = ( 0.0000000 0.3382353 0.7506542), wk = 0.0025381 k( 196) = ( 0.0000000 0.3529412 0.7506542), wk = 0.0025381 k( 197) = ( 0.0000000 0.3676471 0.7506542), wk = 0.0025381 k( 198) = ( 0.0000000 0.3823529 0.7506542), wk = 0.0025381 k( 199) = ( 0.0000000 0.3970588 0.7506542), wk = 0.0025381 k( 200) = ( 0.0000000 0.4117647 0.7506542), wk = 0.0025381 k( 201) = ( 0.0000000 0.4264706 0.7506542), wk = 0.0025381 k( 202) = ( 0.0000000 0.4411765 0.7506542), wk = 0.0025381 k( 203) = ( 0.0000000 0.4558823 0.7506542), wk = 0.0025381 k( 204) = ( 0.0000000 0.4705882 0.7506542), wk = 0.0025381 k( 205) = ( 0.0000000 0.4852941 0.7506542), wk = 0.0025381 k( 206) = ( 0.0000000 0.5000000 0.7506542), wk = 0.0025381 k( 207) = ( 0.0000000 0.5000000 0.7506542), wk = 0.0025381 k( 208) = ( 0.0147059 0.5000000 0.7506542), wk = 0.0025381 k( 209) = ( 0.0294118 0.5000000 0.7506542), wk = 0.0025381 k( 210) = ( 0.0441177 0.5000000 0.7506542), wk = 0.0025381 k( 211) = ( 0.0588235 0.5000000 0.7506542), wk = 0.0025381 k( 212) = ( 0.0735294 0.5000000 0.7506542), wk = 0.0025381 k( 213) = ( 0.0882353 0.5000000 0.7506542), wk = 0.0025381 k( 214) = ( 0.1029412 0.5000000 0.7506542), wk = 0.0025381 k( 215) = ( 0.1176471 0.5000000 0.7506542), wk = 0.0025381 k( 216) = ( 0.1323529 0.5000000 0.7506542), wk = 0.0025381 k( 217) = ( 0.1470588 0.5000000 0.7506542), wk = 0.0025381 k( 218) = ( 0.1617647 0.5000000 0.7506542), wk = 0.0025381 k( 219) = ( 0.1764706 0.5000000 0.7506542), wk = 0.0025381 k( 220) = ( 0.1911765 0.5000000 0.7506542), wk = 0.0025381 k( 221) = ( 0.2058823 0.5000000 0.7506542), wk = 0.0025381 k( 222) = ( 0.2205882 0.5000000 0.7506542), wk = 0.0025381 k( 223) = ( 0.2352941 0.5000000 0.7506542), wk = 0.0025381 k( 224) = ( 0.2500000 0.5000000 0.7506542), wk = 0.0025381 k( 225) = ( 0.2647059 0.5000000 0.7506542), wk = 0.0025381 k( 226) = ( 0.2794118 0.5000000 0.7506542), wk = 0.0025381 k( 227) = ( 0.2941177 0.5000000 0.7506542), wk = 0.0025381 k( 228) = ( 0.3088235 0.5000000 0.7506542), wk = 0.0025381 k( 229) = ( 0.3235294 0.5000000 0.7506542), wk = 0.0025381 k( 230) = ( 0.3382353 0.5000000 0.7506542), wk = 0.0025381 k( 231) = ( 0.3529412 0.5000000 0.7506542), wk = 0.0025381 k( 232) = ( 0.3676471 0.5000000 0.7506542), wk = 0.0025381 k( 233) = ( 0.3823529 0.5000000 0.7506542), wk = 0.0025381 k( 234) = ( 0.3970588 0.5000000 0.7506542), wk = 0.0025381 k( 235) = ( 0.4117647 0.5000000 0.7506542), wk = 0.0025381 k( 236) = ( 0.4264706 0.5000000 0.7506542), wk = 0.0025381 k( 237) = ( 0.4411765 0.5000000 0.7506542), wk = 0.0025381 k( 238) = ( 0.4558823 0.5000000 0.7506542), wk = 0.0025381 k( 239) = ( 0.4705882 0.5000000 0.7506542), wk = 0.0025381 k( 240) = ( 0.4852941 0.5000000 0.7506542), wk = 0.0025381 k( 241) = ( 0.5000000 0.5000000 0.7506542), wk = 0.0025381 k( 242) = ( 0.5000000 0.5000000 0.7506542), wk = 0.0025381 k( 243) = ( 0.4895833 0.4895833 0.7506542), wk = 0.0025381 k( 244) = ( 0.4791667 0.4791667 0.7506542), wk = 0.0025381 k( 245) = ( 0.4687500 0.4687500 0.7506542), wk = 0.0025381 k( 246) = ( 0.4583333 0.4583333 0.7506542), wk = 0.0025381 k( 247) = ( 0.4479167 0.4479167 0.7506542), wk = 0.0025381 k( 248) = ( 0.4375000 0.4375000 0.7506542), wk = 0.0025381 k( 249) = ( 0.4270833 0.4270833 0.7506542), wk = 0.0025381 k( 250) = ( 0.4166667 0.4166667 0.7506542), wk = 0.0025381 k( 251) = ( 0.4062500 0.4062500 0.7506542), wk = 0.0025381 k( 252) = ( 0.3958333 0.3958333 0.7506542), wk = 0.0025381 k( 253) = ( 0.3854167 0.3854167 0.7506542), wk = 0.0025381 k( 254) = ( 0.3750000 0.3750000 0.7506542), wk = 0.0025381 k( 255) = ( 0.3645833 0.3645833 0.7506542), wk = 0.0025381 k( 256) = ( 0.3541667 0.3541667 0.7506542), wk = 0.0025381 k( 257) = ( 0.3437500 0.3437500 0.7506542), wk = 0.0025381 k( 258) = ( 0.3333333 0.3333333 0.7506542), wk = 0.0025381 k( 259) = ( 0.3229167 0.3229167 0.7506542), wk = 0.0025381 k( 260) = ( 0.3125000 0.3125000 0.7506542), wk = 0.0025381 k( 261) = ( 0.3020833 0.3020833 0.7506542), wk = 0.0025381 k( 262) = ( 0.2916667 0.2916667 0.7506542), wk = 0.0025381 k( 263) = ( 0.2812500 0.2812500 0.7506542), wk = 0.0025381 k( 264) = ( 0.2708333 0.2708333 0.7506542), wk = 0.0025381 k( 265) = ( 0.2604167 0.2604167 0.7506542), wk = 0.0025381 k( 266) = ( 0.2500000 0.2500000 0.7506542), wk = 0.0025381 k( 267) = ( 0.2395833 0.2395833 0.7506542), wk = 0.0025381 k( 268) = ( 0.2291667 0.2291667 0.7506542), wk = 0.0025381 k( 269) = ( 0.2187500 0.2187500 0.7506542), wk = 0.0025381 k( 270) = ( 0.2083333 0.2083333 0.7506542), wk = 0.0025381 k( 271) = ( 0.1979167 0.1979167 0.7506542), wk = 0.0025381 k( 272) = ( 0.1875000 0.1875000 0.7506542), wk = 0.0025381 k( 273) = ( 0.1770833 0.1770833 0.7506542), wk = 0.0025381 k( 274) = ( 0.1666667 0.1666667 0.7506542), wk = 0.0025381 k( 275) = ( 0.1562500 0.1562500 0.7506542), wk = 0.0025381 k( 276) = ( 0.1458333 0.1458333 0.7506542), wk = 0.0025381 k( 277) = ( 0.1354167 0.1354167 0.7506542), wk = 0.0025381 k( 278) = ( 0.1250000 0.1250000 0.7506542), wk = 0.0025381 k( 279) = ( 0.1145833 0.1145833 0.7506542), wk = 0.0025381 k( 280) = ( 0.1041667 0.1041667 0.7506542), wk = 0.0025381 k( 281) = ( 0.0937500 0.0937500 0.7506542), wk = 0.0025381 k( 282) = ( 0.0833333 0.0833333 0.7506542), wk = 0.0025381 k( 283) = ( 0.0729167 0.0729167 0.7506542), wk = 0.0025381 k( 284) = ( 0.0625000 0.0625000 0.7506542), wk = 0.0025381 k( 285) = ( 0.0520833 0.0520833 0.7506542), wk = 0.0025381 k( 286) = ( 0.0416667 0.0416667 0.7506542), wk = 0.0025381 k( 287) = ( 0.0312500 0.0312500 0.7506542), wk = 0.0025381 k( 288) = ( 0.0208333 0.0208333 0.7506542), wk = 0.0025381 k( 289) = ( 0.0104167 0.0104167 0.7506542), wk = 0.0025381 k( 290) = ( 0.0000000 0.0000000 0.7506542), wk = 0.0025381 k( 291) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025381 k( 292) = ( 0.0000000 0.5000000 0.0147187), wk = 0.0025381 k( 293) = ( 0.0000000 0.5000000 0.0294374), wk = 0.0025381 k( 294) = ( 0.0000000 0.5000000 0.0441561), wk = 0.0025381 k( 295) = ( 0.0000000 0.5000000 0.0588748), wk = 0.0025381 k( 296) = ( 0.0000000 0.5000000 0.0735935), wk = 0.0025381 k( 297) = ( 0.0000000 0.5000000 0.0883123), wk = 0.0025381 k( 298) = ( 0.0000000 0.5000000 0.1030310), wk = 0.0025381 k( 299) = ( 0.0000000 0.5000000 0.1177497), wk = 0.0025381 k( 300) = ( 0.0000000 0.5000000 0.1324684), wk = 0.0025381 k( 301) = ( 0.0000000 0.5000000 0.1471871), wk = 0.0025381 k( 302) = ( 0.0000000 0.5000000 0.1619058), wk = 0.0025381 k( 303) = ( 0.0000000 0.5000000 0.1766245), wk = 0.0025381 k( 304) = ( 0.0000000 0.5000000 0.1913432), wk = 0.0025381 k( 305) = ( 0.0000000 0.5000000 0.2060619), wk = 0.0025381 k( 306) = ( 0.0000000 0.5000000 0.2207806), wk = 0.0025381 k( 307) = ( 0.0000000 0.5000000 0.2354994), wk = 0.0025381 k( 308) = ( 0.0000000 0.5000000 0.2502181), wk = 0.0025381 k( 309) = ( 0.0000000 0.5000000 0.2649368), wk = 0.0025381 k( 310) = ( 0.0000000 0.5000000 0.2796555), wk = 0.0025381 k( 311) = ( 0.0000000 0.5000000 0.2943742), wk = 0.0025381 k( 312) = ( 0.0000000 0.5000000 0.3090929), wk = 0.0025381 k( 313) = ( 0.0000000 0.5000000 0.3238116), wk = 0.0025381 k( 314) = ( 0.0000000 0.5000000 0.3385303), wk = 0.0025381 k( 315) = ( 0.0000000 0.5000000 0.3532490), wk = 0.0025381 k( 316) = ( 0.0000000 0.5000000 0.3679677), wk = 0.0025381 k( 317) = ( 0.0000000 0.5000000 0.3826864), wk = 0.0025381 k( 318) = ( 0.0000000 0.5000000 0.3974051), wk = 0.0025381 k( 319) = ( 0.0000000 0.5000000 0.4121238), wk = 0.0025381 k( 320) = ( 0.0000000 0.5000000 0.4268426), wk = 0.0025381 k( 321) = ( 0.0000000 0.5000000 0.4415613), wk = 0.0025381 k( 322) = ( 0.0000000 0.5000000 0.4562800), wk = 0.0025381 k( 323) = ( 0.0000000 0.5000000 0.4709987), wk = 0.0025381 k( 324) = ( 0.0000000 0.5000000 0.4857174), wk = 0.0025381 k( 325) = ( 0.0000000 0.5000000 0.5004361), wk = 0.0025381 k( 326) = ( 0.0000000 0.5000000 0.5151548), wk = 0.0025381 k( 327) = ( 0.0000000 0.5000000 0.5298735), wk = 0.0025381 k( 328) = ( 0.0000000 0.5000000 0.5445922), wk = 0.0025381 k( 329) = ( 0.0000000 0.5000000 0.5593109), wk = 0.0025381 k( 330) = ( 0.0000000 0.5000000 0.5740296), wk = 0.0025381 k( 331) = ( 0.0000000 0.5000000 0.5887484), wk = 0.0025381 k( 332) = ( 0.0000000 0.5000000 0.6034671), wk = 0.0025381 k( 333) = ( 0.0000000 0.5000000 0.6181858), wk = 0.0025381 k( 334) = ( 0.0000000 0.5000000 0.6329045), wk = 0.0025381 k( 335) = ( 0.0000000 0.5000000 0.6476232), wk = 0.0025381 k( 336) = ( 0.0000000 0.5000000 0.6623419), wk = 0.0025381 k( 337) = ( 0.0000000 0.5000000 0.6770606), wk = 0.0025381 k( 338) = ( 0.0000000 0.5000000 0.6917793), wk = 0.0025381 k( 339) = ( 0.0000000 0.5000000 0.7064980), wk = 0.0025381 k( 340) = ( 0.0000000 0.5000000 0.7212167), wk = 0.0025381 k( 341) = ( 0.0000000 0.5000000 0.7359355), wk = 0.0025381 k( 342) = ( 0.0000000 0.5000000 0.7506542), wk = 0.0025381 k( 343) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025381 k( 344) = ( 0.5000000 0.5000000 0.0147187), wk = 0.0025381 k( 345) = ( 0.5000000 0.5000000 0.0294374), wk = 0.0025381 k( 346) = ( 0.5000000 0.5000000 0.0441561), wk = 0.0025381 k( 347) = ( 0.5000000 0.5000000 0.0588748), wk = 0.0025381 k( 348) = ( 0.5000000 0.5000000 0.0735935), wk = 0.0025381 k( 349) = ( 0.5000000 0.5000000 0.0883123), wk = 0.0025381 k( 350) = ( 0.5000000 0.5000000 0.1030310), wk = 0.0025381 k( 351) = ( 0.5000000 0.5000000 0.1177497), wk = 0.0025381 k( 352) = ( 0.5000000 0.5000000 0.1324684), wk = 0.0025381 k( 353) = ( 0.5000000 0.5000000 0.1471871), wk = 0.0025381 k( 354) = ( 0.5000000 0.5000000 0.1619058), wk = 0.0025381 k( 355) = ( 0.5000000 0.5000000 0.1766245), wk = 0.0025381 k( 356) = ( 0.5000000 0.5000000 0.1913432), wk = 0.0025381 k( 357) = ( 0.5000000 0.5000000 0.2060619), wk = 0.0025381 k( 358) = ( 0.5000000 0.5000000 0.2207806), wk = 0.0025381 k( 359) = ( 0.5000000 0.5000000 0.2354994), wk = 0.0025381 k( 360) = ( 0.5000000 0.5000000 0.2502181), wk = 0.0025381 k( 361) = ( 0.5000000 0.5000000 0.2649368), wk = 0.0025381 k( 362) = ( 0.5000000 0.5000000 0.2796555), wk = 0.0025381 k( 363) = ( 0.5000000 0.5000000 0.2943742), wk = 0.0025381 k( 364) = ( 0.5000000 0.5000000 0.3090929), wk = 0.0025381 k( 365) = ( 0.5000000 0.5000000 0.3238116), wk = 0.0025381 k( 366) = ( 0.5000000 0.5000000 0.3385303), wk = 0.0025381 k( 367) = ( 0.5000000 0.5000000 0.3532490), wk = 0.0025381 k( 368) = ( 0.5000000 0.5000000 0.3679677), wk = 0.0025381 k( 369) = ( 0.5000000 0.5000000 0.3826864), wk = 0.0025381 k( 370) = ( 0.5000000 0.5000000 0.3974051), wk = 0.0025381 k( 371) = ( 0.5000000 0.5000000 0.4121238), wk = 0.0025381 k( 372) = ( 0.5000000 0.5000000 0.4268426), wk = 0.0025381 k( 373) = ( 0.5000000 0.5000000 0.4415613), wk = 0.0025381 k( 374) = ( 0.5000000 0.5000000 0.4562800), wk = 0.0025381 k( 375) = ( 0.5000000 0.5000000 0.4709987), wk = 0.0025381 k( 376) = ( 0.5000000 0.5000000 0.4857174), wk = 0.0025381 k( 377) = ( 0.5000000 0.5000000 0.5004361), wk = 0.0025381 k( 378) = ( 0.5000000 0.5000000 0.5151548), wk = 0.0025381 k( 379) = ( 0.5000000 0.5000000 0.5298735), wk = 0.0025381 k( 380) = ( 0.5000000 0.5000000 0.5445922), wk = 0.0025381 k( 381) = ( 0.5000000 0.5000000 0.5593109), wk = 0.0025381 k( 382) = ( 0.5000000 0.5000000 0.5740296), wk = 0.0025381 k( 383) = ( 0.5000000 0.5000000 0.5887484), wk = 0.0025381 k( 384) = ( 0.5000000 0.5000000 0.6034671), wk = 0.0025381 k( 385) = ( 0.5000000 0.5000000 0.6181858), wk = 0.0025381 k( 386) = ( 0.5000000 0.5000000 0.6329045), wk = 0.0025381 k( 387) = ( 0.5000000 0.5000000 0.6476232), wk = 0.0025381 k( 388) = ( 0.5000000 0.5000000 0.6623419), wk = 0.0025381 k( 389) = ( 0.5000000 0.5000000 0.6770606), wk = 0.0025381 k( 390) = ( 0.5000000 0.5000000 0.6917793), wk = 0.0025381 k( 391) = ( 0.5000000 0.5000000 0.7064980), wk = 0.0025381 k( 392) = ( 0.5000000 0.5000000 0.7212167), wk = 0.0025381 k( 393) = ( 0.5000000 0.5000000 0.7359355), wk = 0.0025381 k( 394) = ( 0.5000000 0.5000000 0.7506542), wk = 0.0025381 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 2) = ( 0.0000000 0.0147059 0.0000000), wk = 0.0025381 k( 3) = ( 0.0000000 0.0294118 0.0000000), wk = 0.0025381 k( 4) = ( 0.0000000 0.0441177 0.0000000), wk = 0.0025381 k( 5) = ( 0.0000000 0.0588235 0.0000000), wk = 0.0025381 k( 6) = ( 0.0000000 0.0735294 0.0000000), wk = 0.0025381 k( 7) = ( 0.0000000 0.0882353 0.0000000), wk = 0.0025381 k( 8) = ( 0.0000000 0.1029412 0.0000000), wk = 0.0025381 k( 9) = ( 0.0000000 0.1176471 0.0000000), wk = 0.0025381 k( 10) = ( 0.0000000 0.1323529 -0.0000000), wk = 0.0025381 k( 11) = ( 0.0000000 0.1470588 0.0000000), wk = 0.0025381 k( 12) = ( 0.0000000 0.1617647 0.0000000), wk = 0.0025381 k( 13) = ( 0.0000000 0.1764706 0.0000000), wk = 0.0025381 k( 14) = ( 0.0000000 0.1911765 0.0000000), wk = 0.0025381 k( 15) = ( 0.0000000 0.2058823 0.0000000), wk = 0.0025381 k( 16) = ( 0.0000000 0.2205882 0.0000000), wk = 0.0025381 k( 17) = ( 0.0000000 0.2352941 0.0000000), wk = 0.0025381 k( 18) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0025381 k( 19) = ( 0.0000000 0.2647059 -0.0000000), wk = 0.0025381 k( 20) = ( 0.0000000 0.2794118 0.0000000), wk = 0.0025381 k( 21) = ( 0.0000000 0.2941177 -0.0000000), wk = 0.0025381 k( 22) = ( 0.0000000 0.3088235 0.0000000), wk = 0.0025381 k( 23) = ( 0.0000000 0.3235294 -0.0000000), wk = 0.0025381 k( 24) = ( 0.0000000 0.3382353 0.0000000), wk = 0.0025381 k( 25) = ( 0.0000000 0.3529412 0.0000000), wk = 0.0025381 k( 26) = ( 0.0000000 0.3676471 -0.0000000), wk = 0.0025381 k( 27) = ( 0.0000000 0.3823529 0.0000000), wk = 0.0025381 k( 28) = ( 0.0000000 0.3970588 -0.0000000), wk = 0.0025381 k( 29) = ( 0.0000000 0.4117647 -0.0000000), wk = 0.0025381 k( 30) = ( 0.0000000 0.4264706 0.0000000), wk = 0.0025381 k( 31) = ( 0.0000000 0.4411765 0.0000000), wk = 0.0025381 k( 32) = ( 0.0000000 0.4558823 0.0000000), wk = 0.0025381 k( 33) = ( 0.0000000 0.4705882 0.0000000), wk = 0.0025381 k( 34) = ( 0.0000000 0.4852941 0.0000000), wk = 0.0025381 k( 35) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025381 k( 36) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025381 k( 37) = ( 0.0147059 0.5000000 0.0000000), wk = 0.0025381 k( 38) = ( 0.0294118 0.5000000 0.0000000), wk = 0.0025381 k( 39) = ( 0.0441177 0.5000000 0.0000000), wk = 0.0025381 k( 40) = ( 0.0588235 0.5000000 0.0000000), wk = 0.0025381 k( 41) = ( 0.0735294 0.5000000 0.0000000), wk = 0.0025381 k( 42) = ( 0.0882353 0.5000000 0.0000000), wk = 0.0025381 k( 43) = ( 0.1029412 0.5000000 0.0000000), wk = 0.0025381 k( 44) = ( 0.1176471 0.5000000 -0.0000000), wk = 0.0025381 k( 45) = ( 0.1323529 0.5000000 0.0000000), wk = 0.0025381 k( 46) = ( 0.1470588 0.5000000 0.0000000), wk = 0.0025381 k( 47) = ( 0.1617647 0.5000000 0.0000000), wk = 0.0025381 k( 48) = ( 0.1764706 0.5000000 -0.0000000), wk = 0.0025381 k( 49) = ( 0.1911765 0.5000000 0.0000000), wk = 0.0025381 k( 50) = ( 0.2058823 0.5000000 -0.0000000), wk = 0.0025381 k( 51) = ( 0.2205882 0.5000000 0.0000000), wk = 0.0025381 k( 52) = ( 0.2352941 0.5000000 0.0000000), wk = 0.0025381 k( 53) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0025381 k( 54) = ( 0.2647059 0.5000000 -0.0000000), wk = 0.0025381 k( 55) = ( 0.2794118 0.5000000 -0.0000000), wk = 0.0025381 k( 56) = ( 0.2941177 0.5000000 0.0000000), wk = 0.0025381 k( 57) = ( 0.3088235 0.5000000 -0.0000000), wk = 0.0025381 k( 58) = ( 0.3235294 0.5000000 0.0000000), wk = 0.0025381 k( 59) = ( 0.3382353 0.5000000 -0.0000000), wk = 0.0025381 k( 60) = ( 0.3529412 0.5000000 0.0000000), wk = 0.0025381 k( 61) = ( 0.3676471 0.5000000 -0.0000000), wk = 0.0025381 k( 62) = ( 0.3823529 0.5000000 0.0000000), wk = 0.0025381 k( 63) = ( 0.3970588 0.5000000 -0.0000000), wk = 0.0025381 k( 64) = ( 0.4117647 0.5000000 0.0000000), wk = 0.0025381 k( 65) = ( 0.4264706 0.5000000 -0.0000000), wk = 0.0025381 k( 66) = ( 0.4411765 0.5000000 -0.0000000), wk = 0.0025381 k( 67) = ( 0.4558823 0.5000000 0.0000000), wk = 0.0025381 k( 68) = ( 0.4705882 0.5000000 -0.0000000), wk = 0.0025381 k( 69) = ( 0.4852941 0.5000000 -0.0000000), wk = 0.0025381 k( 70) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025381 k( 71) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025381 k( 72) = ( 0.4895833 0.4895833 -0.0000000), wk = 0.0025381 k( 73) = ( 0.4791667 0.4791667 0.0000000), wk = 0.0025381 k( 74) = ( 0.4687500 0.4687500 0.0000000), wk = 0.0025381 k( 75) = ( 0.4583333 0.4583333 -0.0000000), wk = 0.0025381 k( 76) = ( 0.4479167 0.4479167 0.0000000), wk = 0.0025381 k( 77) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0025381 k( 78) = ( 0.4270833 0.4270833 -0.0000000), wk = 0.0025381 k( 79) = ( 0.4166667 0.4166667 0.0000000), wk = 0.0025381 k( 80) = ( 0.4062500 0.4062500 0.0000000), wk = 0.0025381 k( 81) = ( 0.3958333 0.3958333 0.0000000), wk = 0.0025381 k( 82) = ( 0.3854167 0.3854167 0.0000000), wk = 0.0025381 k( 83) = ( 0.3750000 0.3750000 0.0000000), wk = 0.0025381 k( 84) = ( 0.3645833 0.3645833 -0.0000000), wk = 0.0025381 k( 85) = ( 0.3541667 0.3541667 -0.0000000), wk = 0.0025381 k( 86) = ( 0.3437500 0.3437500 0.0000000), wk = 0.0025381 k( 87) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0025381 k( 88) = ( 0.3229167 0.3229167 0.0000000), wk = 0.0025381 k( 89) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0025381 k( 90) = ( 0.3020833 0.3020833 0.0000000), wk = 0.0025381 k( 91) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0025381 k( 92) = ( 0.2812500 0.2812500 0.0000000), wk = 0.0025381 k( 93) = ( 0.2708333 0.2708333 0.0000000), wk = 0.0025381 k( 94) = ( 0.2604167 0.2604167 0.0000000), wk = 0.0025381 k( 95) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0025381 k( 96) = ( 0.2395833 0.2395833 -0.0000000), wk = 0.0025381 k( 97) = ( 0.2291667 0.2291667 -0.0000000), wk = 0.0025381 k( 98) = ( 0.2187500 0.2187500 0.0000000), wk = 0.0025381 k( 99) = ( 0.2083333 0.2083333 0.0000000), wk = 0.0025381 k( 100) = ( 0.1979167 0.1979167 0.0000000), wk = 0.0025381 k( 101) = ( 0.1875000 0.1875000 0.0000000), wk = 0.0025381 k( 102) = ( 0.1770833 0.1770833 -0.0000000), wk = 0.0025381 k( 103) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0025381 k( 104) = ( 0.1562500 0.1562500 -0.0000000), wk = 0.0025381 k( 105) = ( 0.1458333 0.1458333 -0.0000000), wk = 0.0025381 k( 106) = ( 0.1354167 0.1354167 0.0000000), wk = 0.0025381 k( 107) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0025381 k( 108) = ( 0.1145833 0.1145833 -0.0000000), wk = 0.0025381 k( 109) = ( 0.1041667 0.1041667 0.0000000), wk = 0.0025381 k( 110) = ( 0.0937500 0.0937500 0.0000000), wk = 0.0025381 k( 111) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0025381 k( 112) = ( 0.0729167 0.0729167 0.0000000), wk = 0.0025381 k( 113) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0025381 k( 114) = ( 0.0520833 0.0520833 -0.0000000), wk = 0.0025381 k( 115) = ( 0.0416667 0.0416667 0.0000000), wk = 0.0025381 k( 116) = ( 0.0312500 0.0312500 0.0000000), wk = 0.0025381 k( 117) = ( 0.0208333 0.0208333 -0.0000000), wk = 0.0025381 k( 118) = ( 0.0104167 0.0104167 0.0000000), wk = 0.0025381 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025381 k( 121) = ( 0.0000000 0.0000000 0.0098039), wk = 0.0025381 k( 122) = ( 0.0000000 0.0000000 0.0196078), wk = 0.0025381 k( 123) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0025381 k( 124) = ( 0.0000000 0.0000000 0.0392157), wk = 0.0025381 k( 125) = ( 0.0000000 0.0000000 0.0490196), wk = 0.0025381 k( 126) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0025381 k( 127) = ( 0.0000000 0.0000000 0.0686275), wk = 0.0025381 k( 128) = ( 0.0000000 0.0000000 0.0784314), wk = 0.0025381 k( 129) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0025381 k( 130) = ( 0.0000000 0.0000000 0.0980392), wk = 0.0025381 k( 131) = ( 0.0000000 0.0000000 0.1078431), wk = 0.0025381 k( 132) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0025381 k( 133) = ( 0.0000000 0.0000000 0.1274510), wk = 0.0025381 k( 134) = ( 0.0000000 0.0000000 0.1372549), wk = 0.0025381 k( 135) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0025381 k( 136) = ( 0.0000000 0.0000000 0.1568627), wk = 0.0025381 k( 137) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0025381 k( 138) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0025381 k( 139) = ( 0.0000000 0.0000000 0.1862745), wk = 0.0025381 k( 140) = ( 0.0000000 0.0000000 0.1960784), wk = 0.0025381 k( 141) = ( 0.0000000 0.0000000 0.2058823), wk = 0.0025381 k( 142) = ( 0.0000000 0.0000000 0.2156863), wk = 0.0025381 k( 143) = ( 0.0000000 0.0000000 0.2254902), wk = 0.0025381 k( 144) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0025381 k( 145) = ( 0.0000000 0.0000000 0.2450980), wk = 0.0025381 k( 146) = ( 0.0000000 0.0000000 0.2549020), wk = 0.0025381 k( 147) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0025381 k( 148) = ( 0.0000000 0.0000000 0.2745098), wk = 0.0025381 k( 149) = ( 0.0000000 0.0000000 0.2843137), wk = 0.0025381 k( 150) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0025381 k( 151) = ( 0.0000000 0.0000000 0.3039216), wk = 0.0025381 k( 152) = ( 0.0000000 0.0000000 0.3137255), wk = 0.0025381 k( 153) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0025381 k( 154) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0025381 k( 155) = ( 0.0000000 0.0000000 0.3431373), wk = 0.0025381 k( 156) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0025381 k( 157) = ( 0.0000000 0.0000000 0.3627451), wk = 0.0025381 k( 158) = ( 0.0000000 0.0000000 0.3725490), wk = 0.0025381 k( 159) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0025381 k( 160) = ( 0.0000000 0.0000000 0.3921569), wk = 0.0025381 k( 161) = ( 0.0000000 0.0000000 0.4019608), wk = 0.0025381 k( 162) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0025381 k( 163) = ( 0.0000000 0.0000000 0.4215686), wk = 0.0025381 k( 164) = ( 0.0000000 0.0000000 0.4313726), wk = 0.0025381 k( 165) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0025381 k( 166) = ( 0.0000000 0.0000000 0.4509804), wk = 0.0025381 k( 167) = ( 0.0000000 0.0000000 0.4607843), wk = 0.0025381 k( 168) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0025381 k( 169) = ( 0.0000000 0.0000000 0.4803922), wk = 0.0025381 k( 170) = ( 0.0000000 0.0000000 0.4901961), wk = 0.0025381 k( 171) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025381 k( 172) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025381 k( 173) = ( 0.0000000 0.0147059 0.5000000), wk = 0.0025381 k( 174) = ( 0.0000000 0.0294118 0.5000000), wk = 0.0025381 k( 175) = ( 0.0000000 0.0441177 0.5000000), wk = 0.0025381 k( 176) = ( 0.0000000 0.0588235 0.5000000), wk = 0.0025381 k( 177) = ( 0.0000000 0.0735294 0.5000000), wk = 0.0025381 k( 178) = ( 0.0000000 0.0882353 0.5000000), wk = 0.0025381 k( 179) = ( 0.0000000 0.1029412 0.5000000), wk = 0.0025381 k( 180) = ( 0.0000000 0.1176471 0.5000000), wk = 0.0025381 k( 181) = ( 0.0000000 0.1323529 0.5000000), wk = 0.0025381 k( 182) = ( 0.0000000 0.1470588 0.5000000), wk = 0.0025381 k( 183) = ( 0.0000000 0.1617647 0.5000000), wk = 0.0025381 k( 184) = ( 0.0000000 0.1764706 0.5000000), wk = 0.0025381 k( 185) = ( 0.0000000 0.1911765 0.5000000), wk = 0.0025381 k( 186) = ( 0.0000000 0.2058823 0.5000000), wk = 0.0025381 k( 187) = ( 0.0000000 0.2205882 0.5000000), wk = 0.0025381 k( 188) = ( 0.0000000 0.2352941 0.5000000), wk = 0.0025381 k( 189) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0025381 k( 190) = ( 0.0000000 0.2647059 0.5000000), wk = 0.0025381 k( 191) = ( 0.0000000 0.2794118 0.5000000), wk = 0.0025381 k( 192) = ( 0.0000000 0.2941177 0.5000000), wk = 0.0025381 k( 193) = ( 0.0000000 0.3088235 0.5000000), wk = 0.0025381 k( 194) = ( 0.0000000 0.3235294 0.5000000), wk = 0.0025381 k( 195) = ( 0.0000000 0.3382353 0.5000000), wk = 0.0025381 k( 196) = ( 0.0000000 0.3529412 0.5000000), wk = 0.0025381 k( 197) = ( 0.0000000 0.3676471 0.5000000), wk = 0.0025381 k( 198) = ( 0.0000000 0.3823529 0.5000000), wk = 0.0025381 k( 199) = ( 0.0000000 0.3970588 0.5000000), wk = 0.0025381 k( 200) = ( 0.0000000 0.4117647 0.5000000), wk = 0.0025381 k( 201) = ( 0.0000000 0.4264706 0.5000000), wk = 0.0025381 k( 202) = ( 0.0000000 0.4411765 0.5000000), wk = 0.0025381 k( 203) = ( 0.0000000 0.4558823 0.5000000), wk = 0.0025381 k( 204) = ( 0.0000000 0.4705882 0.5000000), wk = 0.0025381 k( 205) = ( 0.0000000 0.4852941 0.5000000), wk = 0.0025381 k( 206) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025381 k( 207) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025381 k( 208) = ( 0.0147059 0.5000000 0.5000000), wk = 0.0025381 k( 209) = ( 0.0294118 0.5000000 0.5000000), wk = 0.0025381 k( 210) = ( 0.0441177 0.5000000 0.5000000), wk = 0.0025381 k( 211) = ( 0.0588235 0.5000000 0.5000000), wk = 0.0025381 k( 212) = ( 0.0735294 0.5000000 0.5000000), wk = 0.0025381 k( 213) = ( 0.0882353 0.5000000 0.5000000), wk = 0.0025381 k( 214) = ( 0.1029412 0.5000000 0.5000000), wk = 0.0025381 k( 215) = ( 0.1176471 0.5000000 0.5000000), wk = 0.0025381 k( 216) = ( 0.1323529 0.5000000 0.5000000), wk = 0.0025381 k( 217) = ( 0.1470588 0.5000000 0.5000000), wk = 0.0025381 k( 218) = ( 0.1617647 0.5000000 0.5000000), wk = 0.0025381 k( 219) = ( 0.1764706 0.5000000 0.5000000), wk = 0.0025381 k( 220) = ( 0.1911765 0.5000000 0.5000000), wk = 0.0025381 k( 221) = ( 0.2058823 0.5000000 0.5000000), wk = 0.0025381 k( 222) = ( 0.2205882 0.5000000 0.5000000), wk = 0.0025381 k( 223) = ( 0.2352941 0.5000000 0.5000000), wk = 0.0025381 k( 224) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0025381 k( 225) = ( 0.2647059 0.5000000 0.5000000), wk = 0.0025381 k( 226) = ( 0.2794118 0.5000000 0.5000000), wk = 0.0025381 k( 227) = ( 0.2941177 0.5000000 0.5000000), wk = 0.0025381 k( 228) = ( 0.3088235 0.5000000 0.5000000), wk = 0.0025381 k( 229) = ( 0.3235294 0.5000000 0.5000000), wk = 0.0025381 k( 230) = ( 0.3382353 0.5000000 0.5000000), wk = 0.0025381 k( 231) = ( 0.3529412 0.5000000 0.5000000), wk = 0.0025381 k( 232) = ( 0.3676471 0.5000000 0.5000000), wk = 0.0025381 k( 233) = ( 0.3823529 0.5000000 0.5000000), wk = 0.0025381 k( 234) = ( 0.3970588 0.5000000 0.5000000), wk = 0.0025381 k( 235) = ( 0.4117647 0.5000000 0.5000000), wk = 0.0025381 k( 236) = ( 0.4264706 0.5000000 0.5000000), wk = 0.0025381 k( 237) = ( 0.4411765 0.5000000 0.5000000), wk = 0.0025381 k( 238) = ( 0.4558823 0.5000000 0.5000000), wk = 0.0025381 k( 239) = ( 0.4705882 0.5000000 0.5000000), wk = 0.0025381 k( 240) = ( 0.4852941 0.5000000 0.5000000), wk = 0.0025381 k( 241) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025381 k( 242) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025381 k( 243) = ( 0.4895833 0.4895833 0.5000000), wk = 0.0025381 k( 244) = ( 0.4791667 0.4791667 0.5000000), wk = 0.0025381 k( 245) = ( 0.4687500 0.4687500 0.5000000), wk = 0.0025381 k( 246) = ( 0.4583333 0.4583333 0.5000000), wk = 0.0025381 k( 247) = ( 0.4479167 0.4479167 0.5000000), wk = 0.0025381 k( 248) = ( 0.4375000 0.4375000 0.5000000), wk = 0.0025381 k( 249) = ( 0.4270833 0.4270833 0.5000000), wk = 0.0025381 k( 250) = ( 0.4166667 0.4166667 0.5000000), wk = 0.0025381 k( 251) = ( 0.4062500 0.4062500 0.5000000), wk = 0.0025381 k( 252) = ( 0.3958333 0.3958333 0.5000000), wk = 0.0025381 k( 253) = ( 0.3854167 0.3854167 0.5000000), wk = 0.0025381 k( 254) = ( 0.3750000 0.3750000 0.5000000), wk = 0.0025381 k( 255) = ( 0.3645833 0.3645833 0.5000000), wk = 0.0025381 k( 256) = ( 0.3541667 0.3541667 0.5000000), wk = 0.0025381 k( 257) = ( 0.3437500 0.3437500 0.5000000), wk = 0.0025381 k( 258) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0025381 k( 259) = ( 0.3229167 0.3229167 0.5000000), wk = 0.0025381 k( 260) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0025381 k( 261) = ( 0.3020833 0.3020833 0.5000000), wk = 0.0025381 k( 262) = ( 0.2916667 0.2916667 0.5000000), wk = 0.0025381 k( 263) = ( 0.2812500 0.2812500 0.5000000), wk = 0.0025381 k( 264) = ( 0.2708333 0.2708333 0.5000000), wk = 0.0025381 k( 265) = ( 0.2604167 0.2604167 0.5000000), wk = 0.0025381 k( 266) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0025381 k( 267) = ( 0.2395833 0.2395833 0.5000000), wk = 0.0025381 k( 268) = ( 0.2291667 0.2291667 0.5000000), wk = 0.0025381 k( 269) = ( 0.2187500 0.2187500 0.5000000), wk = 0.0025381 k( 270) = ( 0.2083333 0.2083333 0.5000000), wk = 0.0025381 k( 271) = ( 0.1979167 0.1979167 0.5000000), wk = 0.0025381 k( 272) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0025381 k( 273) = ( 0.1770833 0.1770833 0.5000000), wk = 0.0025381 k( 274) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0025381 k( 275) = ( 0.1562500 0.1562500 0.5000000), wk = 0.0025381 k( 276) = ( 0.1458333 0.1458333 0.5000000), wk = 0.0025381 k( 277) = ( 0.1354167 0.1354167 0.5000000), wk = 0.0025381 k( 278) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0025381 k( 279) = ( 0.1145833 0.1145833 0.5000000), wk = 0.0025381 k( 280) = ( 0.1041667 0.1041667 0.5000000), wk = 0.0025381 k( 281) = ( 0.0937500 0.0937500 0.5000000), wk = 0.0025381 k( 282) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0025381 k( 283) = ( 0.0729167 0.0729167 0.5000000), wk = 0.0025381 k( 284) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0025381 k( 285) = ( 0.0520833 0.0520833 0.5000000), wk = 0.0025381 k( 286) = ( 0.0416667 0.0416667 0.5000000), wk = 0.0025381 k( 287) = ( 0.0312500 0.0312500 0.5000000), wk = 0.0025381 k( 288) = ( 0.0208333 0.0208333 0.5000000), wk = 0.0025381 k( 289) = ( 0.0104167 0.0104167 0.5000000), wk = 0.0025381 k( 290) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025381 k( 291) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025381 k( 292) = ( 0.0000000 0.5000000 0.0098039), wk = 0.0025381 k( 293) = ( 0.0000000 0.5000000 0.0196078), wk = 0.0025381 k( 294) = ( 0.0000000 0.5000000 0.0294118), wk = 0.0025381 k( 295) = ( 0.0000000 0.5000000 0.0392157), wk = 0.0025381 k( 296) = ( 0.0000000 0.5000000 0.0490196), wk = 0.0025381 k( 297) = ( 0.0000000 0.5000000 0.0588235), wk = 0.0025381 k( 298) = ( 0.0000000 0.5000000 0.0686275), wk = 0.0025381 k( 299) = ( 0.0000000 0.5000000 0.0784314), wk = 0.0025381 k( 300) = ( 0.0000000 0.5000000 0.0882353), wk = 0.0025381 k( 301) = ( 0.0000000 0.5000000 0.0980392), wk = 0.0025381 k( 302) = ( 0.0000000 0.5000000 0.1078431), wk = 0.0025381 k( 303) = ( 0.0000000 0.5000000 0.1176471), wk = 0.0025381 k( 304) = ( 0.0000000 0.5000000 0.1274510), wk = 0.0025381 k( 305) = ( 0.0000000 0.5000000 0.1372549), wk = 0.0025381 k( 306) = ( 0.0000000 0.5000000 0.1470588), wk = 0.0025381 k( 307) = ( 0.0000000 0.5000000 0.1568627), wk = 0.0025381 k( 308) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0025381 k( 309) = ( 0.0000000 0.5000000 0.1764706), wk = 0.0025381 k( 310) = ( 0.0000000 0.5000000 0.1862745), wk = 0.0025381 k( 311) = ( 0.0000000 0.5000000 0.1960784), wk = 0.0025381 k( 312) = ( 0.0000000 0.5000000 0.2058823), wk = 0.0025381 k( 313) = ( 0.0000000 0.5000000 0.2156863), wk = 0.0025381 k( 314) = ( 0.0000000 0.5000000 0.2254902), wk = 0.0025381 k( 315) = ( 0.0000000 0.5000000 0.2352941), wk = 0.0025381 k( 316) = ( 0.0000000 0.5000000 0.2450980), wk = 0.0025381 k( 317) = ( 0.0000000 0.5000000 0.2549020), wk = 0.0025381 k( 318) = ( 0.0000000 0.5000000 0.2647059), wk = 0.0025381 k( 319) = ( 0.0000000 0.5000000 0.2745098), wk = 0.0025381 k( 320) = ( 0.0000000 0.5000000 0.2843137), wk = 0.0025381 k( 321) = ( 0.0000000 0.5000000 0.2941176), wk = 0.0025381 k( 322) = ( 0.0000000 0.5000000 0.3039216), wk = 0.0025381 k( 323) = ( 0.0000000 0.5000000 0.3137255), wk = 0.0025381 k( 324) = ( 0.0000000 0.5000000 0.3235294), wk = 0.0025381 k( 325) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0025381 k( 326) = ( 0.0000000 0.5000000 0.3431373), wk = 0.0025381 k( 327) = ( 0.0000000 0.5000000 0.3529412), wk = 0.0025381 k( 328) = ( 0.0000000 0.5000000 0.3627451), wk = 0.0025381 k( 329) = ( 0.0000000 0.5000000 0.3725490), wk = 0.0025381 k( 330) = ( 0.0000000 0.5000000 0.3823529), wk = 0.0025381 k( 331) = ( 0.0000000 0.5000000 0.3921569), wk = 0.0025381 k( 332) = ( 0.0000000 0.5000000 0.4019608), wk = 0.0025381 k( 333) = ( 0.0000000 0.5000000 0.4117647), wk = 0.0025381 k( 334) = ( 0.0000000 0.5000000 0.4215686), wk = 0.0025381 k( 335) = ( 0.0000000 0.5000000 0.4313726), wk = 0.0025381 k( 336) = ( 0.0000000 0.5000000 0.4411765), wk = 0.0025381 k( 337) = ( 0.0000000 0.5000000 0.4509804), wk = 0.0025381 k( 338) = ( 0.0000000 0.5000000 0.4607843), wk = 0.0025381 k( 339) = ( 0.0000000 0.5000000 0.4705882), wk = 0.0025381 k( 340) = ( 0.0000000 0.5000000 0.4803922), wk = 0.0025381 k( 341) = ( 0.0000000 0.5000000 0.4901961), wk = 0.0025381 k( 342) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025381 k( 343) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025381 k( 344) = ( 0.5000000 0.5000000 0.0098039), wk = 0.0025381 k( 345) = ( 0.5000000 0.5000000 0.0196078), wk = 0.0025381 k( 346) = ( 0.5000000 0.5000000 0.0294118), wk = 0.0025381 k( 347) = ( 0.5000000 0.5000000 0.0392157), wk = 0.0025381 k( 348) = ( 0.5000000 0.5000000 0.0490196), wk = 0.0025381 k( 349) = ( 0.5000000 0.5000000 0.0588235), wk = 0.0025381 k( 350) = ( 0.5000000 0.5000000 0.0686275), wk = 0.0025381 k( 351) = ( 0.5000000 0.5000000 0.0784314), wk = 0.0025381 k( 352) = ( 0.5000000 0.5000000 0.0882353), wk = 0.0025381 k( 353) = ( 0.5000000 0.5000000 0.0980392), wk = 0.0025381 k( 354) = ( 0.5000000 0.5000000 0.1078431), wk = 0.0025381 k( 355) = ( 0.5000000 0.5000000 0.1176471), wk = 0.0025381 k( 356) = ( 0.5000000 0.5000000 0.1274510), wk = 0.0025381 k( 357) = ( 0.5000000 0.5000000 0.1372549), wk = 0.0025381 k( 358) = ( 0.5000000 0.5000000 0.1470588), wk = 0.0025381 k( 359) = ( 0.5000000 0.5000000 0.1568627), wk = 0.0025381 k( 360) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0025381 k( 361) = ( 0.5000000 0.5000000 0.1764706), wk = 0.0025381 k( 362) = ( 0.5000000 0.5000000 0.1862745), wk = 0.0025381 k( 363) = ( 0.5000000 0.5000000 0.1960784), wk = 0.0025381 k( 364) = ( 0.5000000 0.5000000 0.2058823), wk = 0.0025381 k( 365) = ( 0.5000000 0.5000000 0.2156863), wk = 0.0025381 k( 366) = ( 0.5000000 0.5000000 0.2254902), wk = 0.0025381 k( 367) = ( 0.5000000 0.5000000 0.2352941), wk = 0.0025381 k( 368) = ( 0.5000000 0.5000000 0.2450980), wk = 0.0025381 k( 369) = ( 0.5000000 0.5000000 0.2549020), wk = 0.0025381 k( 370) = ( 0.5000000 0.5000000 0.2647059), wk = 0.0025381 k( 371) = ( 0.5000000 0.5000000 0.2745098), wk = 0.0025381 k( 372) = ( 0.5000000 0.5000000 0.2843137), wk = 0.0025381 k( 373) = ( 0.5000000 0.5000000 0.2941177), wk = 0.0025381 k( 374) = ( 0.5000000 0.5000000 0.3039216), wk = 0.0025381 k( 375) = ( 0.5000000 0.5000000 0.3137255), wk = 0.0025381 k( 376) = ( 0.5000000 0.5000000 0.3235294), wk = 0.0025381 k( 377) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0025381 k( 378) = ( 0.5000000 0.5000000 0.3431373), wk = 0.0025381 k( 379) = ( 0.5000000 0.5000000 0.3529412), wk = 0.0025381 k( 380) = ( 0.5000000 0.5000000 0.3627451), wk = 0.0025381 k( 381) = ( 0.5000000 0.5000000 0.3725490), wk = 0.0025381 k( 382) = ( 0.5000000 0.5000000 0.3823529), wk = 0.0025381 k( 383) = ( 0.5000000 0.5000000 0.3921569), wk = 0.0025381 k( 384) = ( 0.5000000 0.5000000 0.4019608), wk = 0.0025381 k( 385) = ( 0.5000000 0.5000000 0.4117647), wk = 0.0025381 k( 386) = ( 0.5000000 0.5000000 0.4215686), wk = 0.0025381 k( 387) = ( 0.5000000 0.5000000 0.4313726), wk = 0.0025381 k( 388) = ( 0.5000000 0.5000000 0.4411765), wk = 0.0025381 k( 389) = ( 0.5000000 0.5000000 0.4509804), wk = 0.0025381 k( 390) = ( 0.5000000 0.5000000 0.4607843), wk = 0.0025381 k( 391) = ( 0.5000000 0.5000000 0.4705882), wk = 0.0025381 k( 392) = ( 0.5000000 0.5000000 0.4803922), wk = 0.0025381 k( 393) = ( 0.5000000 0.5000000 0.4901961), wk = 0.0025381 k( 394) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025381 Dense grid: 44625 G-vectors FFT dimensions: ( 54, 54, 36) Smooth grid: 22323 G-vectors FFT dimensions: ( 45, 45, 27) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.16 Mb ( 172, 62) NL pseudopotentials 0.16 Mb ( 86, 124) Each V/rho on FFT grid 0.04 Mb ( 2916) Each G-vector array 0.01 Mb ( 1240) G-vector shells 0.00 Mb ( 559) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.65 Mb ( 172, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.23 Mb ( 124, 2, 62) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./ZnF2.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.5 secs Computing kpt #: 2 total cpu time spent up to now is 3.1 secs Computing kpt #: 3 total cpu time spent up to now is 3.7 secs Computing kpt #: 4 total cpu time spent up to now is 4.4 secs Computing kpt #: 5 total cpu time spent up to now is 4.9 secs Computing kpt #: 6 total cpu time spent up to now is 5.5 secs Computing kpt #: 7 total cpu time spent up to now is 6.1 secs Computing kpt #: 8 total cpu time spent up to now is 6.6 secs Computing kpt #: 9 total cpu time spent up to now is 7.1 secs Computing kpt #: 10 total cpu time spent up to now is 7.6 secs Computing kpt #: 11 total cpu time spent up to now is 8.1 secs Computing kpt #: 12 total cpu time spent up to now is 8.5 secs Computing kpt #: 13 total cpu time spent up to now is 8.9 secs Computing kpt #: 14 total cpu time spent up to now is 9.3 secs Computing kpt #: 15 total cpu time spent up to now is 9.7 secs Computing kpt #: 16 total cpu time spent up to now is 10.1 secs Computing kpt #: 17 total cpu time spent up to now is 10.4 secs Computing kpt #: 18 total cpu time spent up to now is 10.8 secs Computing kpt #: 19 total cpu time spent up to now is 11.2 secs Computing kpt #: 20 total cpu time spent up to now is 11.6 secs Computing kpt #: 21 total cpu time spent up to now is 12.0 secs Computing kpt #: 22 total cpu time spent up to now is 12.5 secs Computing kpt #: 23 total cpu time spent up to now is 12.8 secs Computing kpt #: 24 total cpu time spent up to now is 13.2 secs Computing kpt #: 25 total cpu time spent up to now is 13.6 secs Computing kpt #: 26 total cpu time spent up to now is 14.0 secs Computing kpt #: 27 total cpu time spent up to now is 14.4 secs Computing kpt #: 28 total cpu time spent up to now is 14.8 secs Computing kpt #: 29 total cpu time spent up to now is 15.2 secs Computing kpt #: 30 total cpu time spent up to now is 15.6 secs Computing kpt #: 31 total cpu time spent up to now is 16.0 secs Computing kpt #: 32 total cpu time spent up to now is 16.4 secs Computing kpt #: 33 total cpu time spent up to now is 16.8 secs Computing kpt #: 34 total cpu time spent up to now is 17.3 secs Computing kpt #: 35 total cpu time spent up to now is 17.6 secs Computing kpt #: 36 total cpu time spent up to now is 17.9 secs Computing kpt #: 37 total cpu time spent up to now is 18.2 secs Computing kpt #: 38 total cpu time spent up to now is 18.5 secs Computing kpt #: 39 total cpu time spent up to now is 18.8 secs Computing kpt #: 40 total cpu time spent up to now is 19.1 secs Computing kpt #: 41 total cpu time spent up to now is 19.5 secs Computing kpt #: 42 total cpu time spent up to now is 19.8 secs Computing kpt #: 43 total cpu time spent up to now is 20.1 secs Computing kpt #: 44 total cpu time spent up to now is 20.4 secs Computing kpt #: 45 total cpu time spent up to now is 20.7 secs Computing kpt #: 46 total cpu time spent up to now is 21.0 secs Computing kpt #: 47 total cpu time spent up to now is 21.3 secs Computing kpt #: 48 total cpu time spent up to now is 21.7 secs Computing kpt #: 49 total cpu time spent up to now is 22.0 secs Computing kpt #: 50 total cpu time spent up to now is 22.3 secs Computing kpt #: 51 total cpu time spent up to now is 22.6 secs Computing kpt #: 52 total cpu time spent up to now is 22.9 secs Computing kpt #: 53 total cpu time spent up to now is 23.3 secs Computing kpt #: 54 total cpu time spent up to now is 23.6 secs Computing kpt #: 55 total cpu time spent up to now is 23.9 secs Computing kpt #: 56 total cpu time spent up to now is 24.2 secs Computing kpt #: 57 total cpu time spent up to now is 24.6 secs Computing kpt #: 58 total cpu time spent up to now is 24.9 secs Computing kpt #: 59 total cpu time spent up to now is 25.2 secs Computing kpt #: 60 total cpu time spent up to now is 25.5 secs Computing kpt #: 61 total cpu time spent up to now is 25.9 secs Computing kpt #: 62 total cpu time spent up to now is 26.2 secs Computing kpt #: 63 total cpu time spent up to now is 26.5 secs Computing kpt #: 64 total cpu time spent up to now is 26.8 secs Computing kpt #: 65 total cpu time spent up to now is 27.1 secs Computing kpt #: 66 total cpu time spent up to now is 27.5 secs Computing kpt #: 67 total cpu time spent up to now is 27.8 secs Computing kpt #: 68 total cpu time spent up to now is 28.1 secs Computing kpt #: 69 total cpu time spent up to now is 28.5 secs Computing kpt #: 70 total cpu time spent up to now is 28.8 secs Computing kpt #: 71 total cpu time spent up to now is 29.1 secs Computing kpt #: 72 total cpu time spent up to now is 29.6 secs Computing kpt #: 73 total cpu time spent up to now is 30.0 secs Computing kpt #: 74 total cpu time spent up to now is 30.3 secs Computing kpt #: 75 total cpu time spent up to now is 30.7 secs Computing kpt #: 76 total cpu time spent up to now is 31.1 secs Computing kpt #: 77 total cpu time spent up to now is 31.4 secs Computing kpt #: 78 total cpu time spent up to now is 31.8 secs Computing kpt #: 79 total cpu time spent up to now is 32.1 secs Computing kpt #: 80 total cpu time spent up to now is 32.4 secs Computing kpt #: 81 total cpu time spent up to now is 32.8 secs Computing kpt #: 82 total cpu time spent up to now is 33.1 secs Computing kpt #: 83 total cpu time spent up to now is 33.4 secs Computing kpt #: 84 total cpu time spent up to now is 33.8 secs Computing kpt #: 85 total cpu time spent up to now is 34.1 secs Computing kpt #: 86 total cpu time spent up to now is 34.4 secs Computing kpt #: 87 total cpu time spent up to now is 34.7 secs Computing kpt #: 88 total cpu time spent up to now is 35.1 secs Computing kpt #: 89 total cpu time spent up to now is 35.4 secs Computing kpt #: 90 total cpu time spent up to now is 35.7 secs Computing kpt #: 91 total cpu time spent up to now is 36.0 secs Computing kpt #: 92 total cpu time spent up to now is 36.4 secs Computing kpt #: 93 total cpu time spent up to now is 36.7 secs Computing kpt #: 94 total cpu time spent up to now is 37.0 secs Computing kpt #: 95 total cpu time spent up to now is 37.4 secs Computing kpt #: 96 total cpu time spent up to now is 37.7 secs Computing kpt #: 97 total cpu time spent up to now is 38.0 secs Computing kpt #: 98 total cpu time spent up to now is 38.4 secs Computing kpt #: 99 total cpu time spent up to now is 38.7 secs Computing kpt #: 100 total cpu time spent up to now is 39.0 secs Computing kpt #: 101 total cpu time spent up to now is 39.3 secs Computing kpt #: 102 total cpu time spent up to now is 39.6 secs Computing kpt #: 103 total cpu time spent up to now is 40.0 secs Computing kpt #: 104 total cpu time spent up to now is 40.3 secs Computing kpt #: 105 total cpu time spent up to now is 40.6 secs Computing kpt #: 106 total cpu time spent up to now is 41.0 secs Computing kpt #: 107 total cpu time spent up to now is 41.3 secs Computing kpt #: 108 total cpu time spent up to now is 41.7 secs Computing kpt #: 109 total cpu time spent up to now is 42.0 secs Computing kpt #: 110 total cpu time spent up to now is 42.5 secs Computing kpt #: 111 total cpu time spent up to now is 42.9 secs Computing kpt #: 112 total cpu time spent up to now is 43.5 secs Computing kpt #: 113 total cpu time spent up to now is 44.1 secs Computing kpt #: 114 total cpu time spent up to now is 44.6 secs Computing kpt #: 115 total cpu time spent up to now is 45.2 secs Computing kpt #: 116 total cpu time spent up to now is 45.9 secs Computing kpt #: 117 total cpu time spent up to now is 46.6 secs Computing kpt #: 118 total cpu time spent up to now is 47.3 secs Computing kpt #: 119 total cpu time spent up to now is 47.9 secs Computing kpt #: 120 total cpu time spent up to now is 48.4 secs Computing kpt #: 121 total cpu time spent up to now is 49.0 secs Computing kpt #: 122 total cpu time spent up to now is 49.4 secs Computing kpt #: 123 total cpu time spent up to now is 50.0 secs Computing kpt #: 124 total cpu time spent up to now is 50.6 secs Computing kpt #: 125 total cpu time spent up to now is 51.2 secs Computing kpt #: 126 total cpu time spent up to now is 51.9 secs Computing kpt #: 127 total cpu time spent up to now is 52.6 secs Computing kpt #: 128 total cpu time spent up to now is 53.3 secs Computing kpt #: 129 total cpu time spent up to now is 53.9 secs Computing kpt #: 130 total cpu time spent up to now is 54.4 secs Computing kpt #: 131 total cpu time spent up to now is 54.9 secs Computing kpt #: 132 total cpu time spent up to now is 55.5 secs Computing kpt #: 133 total cpu time spent up to now is 56.1 secs Computing kpt #: 134 total cpu time spent up to now is 56.6 secs Computing kpt #: 135 total cpu time spent up to now is 57.1 secs Computing kpt #: 136 total cpu time spent up to now is 57.7 secs Computing kpt #: 137 total cpu time spent up to now is 58.2 secs Computing kpt #: 138 total cpu time spent up to now is 58.7 secs Computing kpt #: 139 total cpu time spent up to now is 59.3 secs Computing kpt #: 140 total cpu time spent up to now is 59.8 secs Computing kpt #: 141 total cpu time spent up to now is 60.2 secs Computing kpt #: 142 total cpu time spent up to now is 60.7 secs Computing kpt #: 143 total cpu time spent up to now is 61.2 secs Computing kpt #: 144 total cpu time spent up to now is 61.7 secs Computing kpt #: 145 total cpu time spent up to now is 62.2 secs Computing kpt #: 146 total cpu time spent up to now is 62.6 secs Computing kpt #: 147 total cpu time spent up to now is 63.1 secs Computing kpt #: 148 total cpu time spent up to now is 63.6 secs Computing kpt #: 149 total cpu time spent up to now is 64.1 secs Computing kpt #: 150 total cpu time spent up to now is 64.5 secs Computing kpt #: 151 total cpu time spent up to now is 64.9 secs Computing kpt #: 152 total cpu time spent up to now is 65.4 secs Computing kpt #: 153 total cpu time spent up to now is 65.8 secs Computing kpt #: 154 total cpu time spent up to now is 66.3 secs Computing kpt #: 155 total cpu time spent up to now is 66.7 secs Computing kpt #: 156 total cpu time spent up to now is 67.1 secs Computing kpt #: 157 total cpu time spent up to now is 67.6 secs Computing kpt #: 158 total cpu time spent up to now is 68.0 secs Computing kpt #: 159 total cpu time spent up to now is 68.4 secs Computing kpt #: 160 total cpu time spent up to now is 68.9 secs Computing kpt #: 161 total cpu time spent up to now is 69.3 secs Computing kpt #: 162 total cpu time spent up to now is 69.7 secs Computing kpt #: 163 total cpu time spent up to now is 70.1 secs Computing kpt #: 164 total cpu time spent up to now is 70.5 secs Computing kpt #: 165 total cpu time spent up to now is 71.0 secs Computing kpt #: 166 total cpu time spent up to now is 71.4 secs Computing kpt #: 167 total cpu time spent up to now is 71.8 secs Computing kpt #: 168 total cpu time spent up to now is 72.3 secs Computing kpt #: 169 total cpu time spent up to now is 72.8 secs Computing kpt #: 170 total cpu time spent up to now is 73.2 secs Computing kpt #: 171 total cpu time spent up to now is 73.5 secs Computing kpt #: 172 total cpu time spent up to now is 73.9 secs Computing kpt #: 173 total cpu time spent up to now is 74.3 secs Computing kpt #: 174 total cpu time spent up to now is 74.8 secs Computing kpt #: 175 total cpu time spent up to now is 75.3 secs Computing kpt #: 176 total cpu time spent up to now is 75.7 secs Computing kpt #: 177 total cpu time spent up to now is 76.2 secs Computing kpt #: 178 total cpu time spent up to now is 76.6 secs Computing kpt #: 179 total cpu time spent up to now is 77.1 secs Computing kpt #: 180 total cpu time spent up to now is 77.5 secs Computing kpt #: 181 total cpu time spent up to now is 78.0 secs Computing kpt #: 182 total cpu time spent up to now is 78.4 secs Computing kpt #: 183 total cpu time spent up to now is 78.9 secs Computing kpt #: 184 total cpu time spent up to now is 79.3 secs Computing kpt #: 185 total cpu time spent up to now is 79.8 secs Computing kpt #: 186 total cpu time spent up to now is 80.2 secs Computing kpt #: 187 total cpu time spent up to now is 80.7 secs Computing kpt #: 188 total cpu time spent up to now is 81.3 secs Computing kpt #: 189 total cpu time spent up to now is 82.0 secs Computing kpt #: 190 total cpu time spent up to now is 82.6 secs Computing kpt #: 191 total cpu time spent up to now is 83.0 secs Computing kpt #: 192 total cpu time spent up to now is 83.7 secs Computing kpt #: 193 total cpu time spent up to now is 84.2 secs Computing kpt #: 194 total cpu time spent up to now is 84.8 secs Computing kpt #: 195 total cpu time spent up to now is 85.4 secs Computing kpt #: 196 total cpu time spent up to now is 86.1 secs Computing kpt #: 197 total cpu time spent up to now is 86.7 secs Computing kpt #: 198 total cpu time spent up to now is 87.3 secs Computing kpt #: 199 total cpu time spent up to now is 87.9 secs Computing kpt #: 200 total cpu time spent up to now is 88.5 secs Computing kpt #: 201 total cpu time spent up to now is 89.1 secs Computing kpt #: 202 total cpu time spent up to now is 89.7 secs Computing kpt #: 203 total cpu time spent up to now is 90.3 secs Computing kpt #: 204 total cpu time spent up to now is 90.8 secs Computing kpt #: 205 total cpu time spent up to now is 91.3 secs Computing kpt #: 206 total cpu time spent up to now is 91.9 secs Computing kpt #: 207 total cpu time spent up to now is 92.3 secs Computing kpt #: 208 total cpu time spent up to now is 92.8 secs Computing kpt #: 209 total cpu time spent up to now is 93.4 secs Computing kpt #: 210 total cpu time spent up to now is 94.0 secs Computing kpt #: 211 total cpu time spent up to now is 94.6 secs Computing kpt #: 212 total cpu time spent up to now is 95.2 secs Computing kpt #: 213 total cpu time spent up to now is 95.9 secs Computing kpt #: 214 total cpu time spent up to now is 96.3 secs Computing kpt #: 215 total cpu time spent up to now is 97.0 secs Computing kpt #: 216 total cpu time spent up to now is 97.6 secs Computing kpt #: 217 total cpu time spent up to now is 98.1 secs Computing kpt #: 218 total cpu time spent up to now is 98.6 secs Computing kpt #: 219 total cpu time spent up to now is 99.1 secs Computing kpt #: 220 total cpu time spent up to now is 99.6 secs Computing kpt #: 221 total cpu time spent up to now is 100.1 secs Computing kpt #: 222 total cpu time spent up to now is 100.6 secs Computing kpt #: 223 total cpu time spent up to now is 101.1 secs Computing kpt #: 224 total cpu time spent up to now is 101.8 secs Computing kpt #: 225 total cpu time spent up to now is 102.3 secs Computing kpt #: 226 total cpu time spent up to now is 102.8 secs Computing kpt #: 227 total cpu time spent up to now is 103.2 secs Computing kpt #: 228 total cpu time spent up to now is 103.8 secs Computing kpt #: 229 total cpu time spent up to now is 104.1 secs Computing kpt #: 230 total cpu time spent up to now is 104.5 secs Computing kpt #: 231 total cpu time spent up to now is 104.9 secs Computing kpt #: 232 total cpu time spent up to now is 105.3 secs Computing kpt #: 233 total cpu time spent up to now is 105.7 secs Computing kpt #: 234 total cpu time spent up to now is 106.1 secs Computing kpt #: 235 total cpu time spent up to now is 106.5 secs Computing kpt #: 236 total cpu time spent up to now is 106.9 secs Computing kpt #: 237 total cpu time spent up to now is 107.2 secs Computing kpt #: 238 total cpu time spent up to now is 107.6 secs Computing kpt #: 239 total cpu time spent up to now is 108.0 secs Computing kpt #: 240 total cpu time spent up to now is 108.4 secs Computing kpt #: 241 total cpu time spent up to now is 108.7 secs Computing kpt #: 242 total cpu time spent up to now is 109.1 secs Computing kpt #: 243 total cpu time spent up to now is 109.4 secs Computing kpt #: 244 total cpu time spent up to now is 109.8 secs Computing kpt #: 245 total cpu time spent up to now is 110.2 secs Computing kpt #: 246 total cpu time spent up to now is 110.5 secs Computing kpt #: 247 total cpu time spent up to now is 110.9 secs Computing kpt #: 248 total cpu time spent up to now is 111.3 secs Computing kpt #: 249 total cpu time spent up to now is 111.6 secs Computing kpt #: 250 total cpu time spent up to now is 112.0 secs Computing kpt #: 251 total cpu time spent up to now is 112.3 secs Computing kpt #: 252 total cpu time spent up to now is 112.7 secs Computing kpt #: 253 total cpu time spent up to now is 113.1 secs Computing kpt #: 254 total cpu time spent up to now is 113.4 secs Computing kpt #: 255 total cpu time spent up to now is 113.8 secs Computing kpt #: 256 total cpu time spent up to now is 114.2 secs Computing kpt #: 257 total cpu time spent up to now is 114.5 secs Computing kpt #: 258 total cpu time spent up to now is 114.9 secs Computing kpt #: 259 total cpu time spent up to now is 115.3 secs Computing kpt #: 260 total cpu time spent up to now is 115.6 secs Computing kpt #: 261 total cpu time spent up to now is 116.0 secs Computing kpt #: 262 total cpu time spent up to now is 116.4 secs Computing kpt #: 263 total cpu time spent up to now is 116.8 secs Computing kpt #: 264 total cpu time spent up to now is 117.2 secs Computing kpt #: 265 total cpu time spent up to now is 117.6 secs Computing kpt #: 266 total cpu time spent up to now is 118.0 secs Computing kpt #: 267 total cpu time spent up to now is 118.4 secs Computing kpt #: 268 total cpu time spent up to now is 118.9 secs Computing kpt #: 269 total cpu time spent up to now is 119.3 secs Computing kpt #: 270 total cpu time spent up to now is 119.8 secs Computing kpt #: 271 total cpu time spent up to now is 120.2 secs Computing kpt #: 272 total cpu time spent up to now is 120.6 secs Computing kpt #: 273 total cpu time spent up to now is 120.9 secs Computing kpt #: 274 total cpu time spent up to now is 121.3 secs Computing kpt #: 275 total cpu time spent up to now is 121.7 secs Computing kpt #: 276 total cpu time spent up to now is 122.1 secs Computing kpt #: 277 total cpu time spent up to now is 122.4 secs Computing kpt #: 278 total cpu time spent up to now is 122.8 secs Computing kpt #: 279 total cpu time spent up to now is 123.1 secs Computing kpt #: 280 total cpu time spent up to now is 123.5 secs Computing kpt #: 281 total cpu time spent up to now is 123.9 secs Computing kpt #: 282 total cpu time spent up to now is 124.2 secs Computing kpt #: 283 total cpu time spent up to now is 124.6 secs Computing kpt #: 284 total cpu time spent up to now is 125.0 secs Computing kpt #: 285 total cpu time spent up to now is 125.4 secs Computing kpt #: 286 total cpu time spent up to now is 125.9 secs Computing kpt #: 287 total cpu time spent up to now is 126.3 secs Computing kpt #: 288 total cpu time spent up to now is 126.8 secs Computing kpt #: 289 total cpu time spent up to now is 127.3 secs Computing kpt #: 290 total cpu time spent up to now is 127.6 secs Computing kpt #: 291 total cpu time spent up to now is 128.0 secs Computing kpt #: 292 total cpu time spent up to now is 128.4 secs Computing kpt #: 293 total cpu time spent up to now is 128.8 secs Computing kpt #: 294 total cpu time spent up to now is 129.4 secs Computing kpt #: 295 total cpu time spent up to now is 129.9 secs Computing kpt #: 296 total cpu time spent up to now is 130.3 secs Computing kpt #: 297 total cpu time spent up to now is 130.7 secs Computing kpt #: 298 total cpu time spent up to now is 131.2 secs Computing kpt #: 299 total cpu time spent up to now is 131.6 secs Computing kpt #: 300 total cpu time spent up to now is 132.0 secs Computing kpt #: 301 total cpu time spent up to now is 132.4 secs Computing kpt #: 302 total cpu time spent up to now is 132.9 secs Computing kpt #: 303 total cpu time spent up to now is 133.3 secs Computing kpt #: 304 total cpu time spent up to now is 133.7 secs Computing kpt #: 305 total cpu time spent up to now is 134.2 secs Computing kpt #: 306 total cpu time spent up to now is 134.6 secs Computing kpt #: 307 total cpu time spent up to now is 135.0 secs Computing kpt #: 308 total cpu time spent up to now is 135.4 secs Computing kpt #: 309 total cpu time spent up to now is 135.9 secs Computing kpt #: 310 total cpu time spent up to now is 136.2 secs Computing kpt #: 311 total cpu time spent up to now is 136.7 secs Computing kpt #: 312 total cpu time spent up to now is 137.1 secs Computing kpt #: 313 total cpu time spent up to now is 137.4 secs Computing kpt #: 314 total cpu time spent up to now is 137.8 secs Computing kpt #: 315 total cpu time spent up to now is 138.2 secs Computing kpt #: 316 total cpu time spent up to now is 138.6 secs Computing kpt #: 317 total cpu time spent up to now is 139.0 secs Computing kpt #: 318 total cpu time spent up to now is 139.4 secs Computing kpt #: 319 total cpu time spent up to now is 139.7 secs Computing kpt #: 320 total cpu time spent up to now is 140.1 secs Computing kpt #: 321 total cpu time spent up to now is 140.5 secs Computing kpt #: 322 total cpu time spent up to now is 140.9 secs Computing kpt #: 323 total cpu time spent up to now is 141.3 secs Computing kpt #: 324 total cpu time spent up to now is 141.7 secs Computing kpt #: 325 total cpu time spent up to now is 142.1 secs Computing kpt #: 326 total cpu time spent up to now is 142.6 secs Computing kpt #: 327 total cpu time spent up to now is 143.0 secs Computing kpt #: 328 total cpu time spent up to now is 143.4 secs Computing kpt #: 329 total cpu time spent up to now is 143.9 secs Computing kpt #: 330 total cpu time spent up to now is 144.4 secs Computing kpt #: 331 total cpu time spent up to now is 144.9 secs Computing kpt #: 332 total cpu time spent up to now is 145.5 secs Computing kpt #: 333 total cpu time spent up to now is 146.1 secs Computing kpt #: 334 total cpu time spent up to now is 146.6 secs Computing kpt #: 335 total cpu time spent up to now is 147.1 secs Computing kpt #: 336 total cpu time spent up to now is 147.6 secs Computing kpt #: 337 total cpu time spent up to now is 148.2 secs Computing kpt #: 338 total cpu time spent up to now is 148.8 secs Computing kpt #: 339 total cpu time spent up to now is 149.2 secs Computing kpt #: 340 total cpu time spent up to now is 149.7 secs Computing kpt #: 341 total cpu time spent up to now is 150.2 secs Computing kpt #: 342 total cpu time spent up to now is 150.6 secs Computing kpt #: 343 total cpu time spent up to now is 150.9 secs Computing kpt #: 344 total cpu time spent up to now is 151.3 secs Computing kpt #: 345 total cpu time spent up to now is 151.6 secs Computing kpt #: 346 total cpu time spent up to now is 152.0 secs Computing kpt #: 347 total cpu time spent up to now is 152.3 secs Computing kpt #: 348 total cpu time spent up to now is 152.6 secs Computing kpt #: 349 total cpu time spent up to now is 152.9 secs Computing kpt #: 350 total cpu time spent up to now is 153.3 secs Computing kpt #: 351 total cpu time spent up to now is 153.6 secs Computing kpt #: 352 total cpu time spent up to now is 153.9 secs Computing kpt #: 353 total cpu time spent up to now is 154.2 secs Computing kpt #: 354 total cpu time spent up to now is 154.5 secs Computing kpt #: 355 total cpu time spent up to now is 154.9 secs Computing kpt #: 356 total cpu time spent up to now is 155.2 secs Computing kpt #: 357 total cpu time spent up to now is 155.5 secs Computing kpt #: 358 total cpu time spent up to now is 155.9 secs Computing kpt #: 359 total cpu time spent up to now is 156.2 secs Computing kpt #: 360 total cpu time spent up to now is 156.6 secs Computing kpt #: 361 total cpu time spent up to now is 157.0 secs Computing kpt #: 362 total cpu time spent up to now is 157.5 secs Computing kpt #: 363 total cpu time spent up to now is 158.0 secs Computing kpt #: 364 total cpu time spent up to now is 158.5 secs Computing kpt #: 365 total cpu time spent up to now is 158.9 secs Computing kpt #: 366 total cpu time spent up to now is 159.3 secs Computing kpt #: 367 total cpu time spent up to now is 159.7 secs Computing kpt #: 368 total cpu time spent up to now is 160.1 secs Computing kpt #: 369 total cpu time spent up to now is 160.4 secs Computing kpt #: 370 total cpu time spent up to now is 160.7 secs Computing kpt #: 371 total cpu time spent up to now is 161.1 secs Computing kpt #: 372 total cpu time spent up to now is 161.4 secs Computing kpt #: 373 total cpu time spent up to now is 161.8 secs Computing kpt #: 374 total cpu time spent up to now is 162.1 secs Computing kpt #: 375 total cpu time spent up to now is 162.4 secs Computing kpt #: 376 total cpu time spent up to now is 162.8 secs Computing kpt #: 377 total cpu time spent up to now is 163.3 secs Computing kpt #: 378 total cpu time spent up to now is 163.7 secs Computing kpt #: 379 total cpu time spent up to now is 164.2 secs Computing kpt #: 380 total cpu time spent up to now is 164.5 secs Computing kpt #: 381 total cpu time spent up to now is 164.9 secs Computing kpt #: 382 total cpu time spent up to now is 165.2 secs Computing kpt #: 383 total cpu time spent up to now is 165.6 secs Computing kpt #: 384 total cpu time spent up to now is 165.9 secs Computing kpt #: 385 total cpu time spent up to now is 166.2 secs Computing kpt #: 386 total cpu time spent up to now is 166.6 secs Computing kpt #: 387 total cpu time spent up to now is 166.9 secs Computing kpt #: 388 total cpu time spent up to now is 167.3 secs Computing kpt #: 389 total cpu time spent up to now is 167.6 secs Computing kpt #: 390 total cpu time spent up to now is 168.0 secs Computing kpt #: 391 total cpu time spent up to now is 168.3 secs Computing kpt #: 392 total cpu time spent up to now is 168.7 secs Computing kpt #: 393 total cpu time spent up to now is 169.1 secs Computing kpt #: 394 total cpu time spent up to now is 169.4 secs ethr = 1.92E-08, avg # of iterations = 23.1 total cpu time spent up to now is 169.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2777 PWs) bands (ev): -18.0789 -18.0789 -17.3124 -17.3124 -17.3092 -17.3092 -17.2637 -17.2637 -2.4459 -2.4459 -1.5790 -1.5790 -0.8063 -0.8063 -0.7646 -0.7646 -0.7360 -0.7360 0.3870 0.3870 0.4059 0.4059 0.5586 0.5586 0.6403 0.6403 0.7026 0.7026 0.7666 0.7666 0.8582 0.8582 0.9758 0.9758 1.3239 1.3239 1.7533 1.7533 2.1734 2.1734 2.2369 2.2369 2.2756 2.2756 2.6122 2.6122 3.4092 3.4092 3.4546 3.4546 3.8127 3.8127 7.3193 7.3193 13.1909 13.1909 13.4396 13.4396 13.5160 13.5160 17.3201 17.3201 k = 0.0000 0.0147-0.0000 ( 2778 PWs) bands (ev): -18.0785 -18.0785 -17.3131 -17.3131 -17.3096 -17.3096 -17.2629 -17.2629 -2.4448 -2.4448 -1.5786 -1.5786 -0.8062 -0.8062 -0.7645 -0.7645 -0.7355 -0.7355 0.3834 0.3834 0.4015 0.4015 0.5555 0.5555 0.6446 0.6446 0.7044 0.7044 0.7671 0.7671 0.8588 0.8588 0.9770 0.9770 1.3247 1.3247 1.7535 1.7535 2.1732 2.1732 2.2367 2.2367 2.2752 2.2752 2.6117 2.6117 3.4091 3.4091 3.4544 3.4544 3.8122 3.8122 7.3227 7.3227 13.1712 13.1712 13.4494 13.4494 13.5252 13.5252 17.3218 17.3218 k = 0.0000 0.0294-0.0000 ( 2782 PWs) bands (ev): -18.0775 -18.0775 -17.3161 -17.3161 -17.3100 -17.3100 -17.2606 -17.2606 -2.4416 -2.4416 -1.5775 -1.5775 -0.8059 -0.8059 -0.7644 -0.7644 -0.7338 -0.7338 0.3729 0.3729 0.3888 0.3888 0.5477 0.5477 0.6554 0.6554 0.7098 0.7098 0.7685 0.7685 0.8608 0.8608 0.9807 0.9807 1.3264 1.3264 1.7541 1.7541 2.1726 2.1726 2.2352 2.2352 2.2748 2.2748 2.6101 2.6101 3.4086 3.4086 3.4537 3.4537 3.8109 3.8109 7.3325 7.3325 13.1221 13.1221 13.4664 13.4664 13.5550 13.5550 17.3241 17.3241 k = 0.0000 0.0441-0.0000 ( 2782 PWs) bands (ev): -18.0758 -18.0758 -17.3213 -17.3213 -17.3099 -17.3099 -17.2575 -17.2575 -2.4362 -2.4362 -1.5757 -1.5757 -0.8053 -0.8053 -0.7641 -0.7641 -0.7308 -0.7308 0.3560 0.3560 0.3696 0.3696 0.5374 0.5374 0.6692 0.6692 0.7170 0.7170 0.7716 0.7716 0.8642 0.8642 0.9867 0.9867 1.3293 1.3293 1.7551 1.7551 2.1717 2.1717 2.2312 2.2312 2.2758 2.2758 2.6077 2.6077 3.4077 3.4077 3.4527 3.4527 3.8087 3.8087 7.3489 7.3489 13.0577 13.0577 13.4800 13.4800 13.6019 13.6019 17.3112 17.3112 k = 0.0000 0.0588-0.0000 ( 2780 PWs) bands (ev): -18.0735 -18.0735 -17.3280 -17.3280 -17.3095 -17.3095 -17.2540 -17.2540 -2.4287 -2.4287 -1.5731 -1.5731 -0.8044 -0.8044 -0.7637 -0.7637 -0.7268 -0.7268 0.3336 0.3336 0.3457 0.3457 0.5261 0.5261 0.6828 0.6828 0.7238 0.7238 0.7776 0.7776 0.8693 0.8693 0.9948 0.9948 1.3335 1.3335 1.7565 1.7565 2.1704 2.1704 2.2233 2.2233 2.2798 2.2798 2.6042 2.6042 3.4066 3.4066 3.4513 3.4513 3.8056 3.8056 7.3718 7.3718 12.9851 12.9851 13.4922 13.4922 13.6568 13.6568 17.2883 17.2883 k = 0.0000 0.0735-0.0000 ( 2786 PWs) bands (ev): -18.0705 -18.0705 -17.3357 -17.3357 -17.3089 -17.3089 -17.2503 -17.2503 -2.4190 -2.4190 -1.5697 -1.5697 -0.8034 -0.8034 -0.7632 -0.7632 -0.7215 -0.7215 0.3066 0.3066 0.3185 0.3185 0.5142 0.5142 0.6938 0.6938 0.7289 0.7289 0.7870 0.7870 0.8765 0.8765 1.0047 1.0047 1.3391 1.3391 1.7581 1.7581 2.1687 2.1687 2.2114 2.2114 2.2870 2.2870 2.5997 2.5997 3.4050 3.4050 3.4495 3.4495 3.8015 3.8015 7.4009 7.4009 12.9075 12.9075 13.5052 13.5052 13.7145 13.7145 17.2601 17.2601 k = 0.0000 0.0882-0.0000 ( 2786 PWs) bands (ev): -18.0668 -18.0668 -17.3443 -17.3443 -17.3081 -17.3081 -17.2467 -17.2467 -2.4073 -2.4073 -1.5657 -1.5657 -0.8022 -0.8022 -0.7626 -0.7626 -0.7150 -0.7150 0.2760 0.2760 0.2888 0.2888 0.5020 0.5020 0.7005 0.7005 0.7323 0.7323 0.7995 0.7995 0.8864 0.8864 1.0160 1.0160 1.3461 1.3461 1.7600 1.7600 2.1667 2.1667 2.1962 2.1962 2.2971 2.2971 2.5943 2.5943 3.4032 3.4032 3.4473 3.4473 3.7964 3.7964 7.4361 7.4361 12.8262 12.8262 13.5198 13.5198 13.7725 13.7725 17.2279 17.2279 k = 0.0000 0.1029-0.0000 ( 2786 PWs) bands (ev): -18.0625 -18.0625 -17.3537 -17.3537 -17.3072 -17.3072 -17.2432 -17.2432 -2.3935 -2.3935 -1.5610 -1.5610 -0.8008 -0.8008 -0.7619 -0.7619 -0.7073 -0.7073 0.2429 0.2429 0.2571 0.2571 0.4896 0.4896 0.7022 0.7022 0.7343 0.7343 0.8139 0.8139 0.8993 0.8993 1.0281 1.0281 1.3547 1.3547 1.7621 1.7621 2.1639 2.1639 2.1789 2.1789 2.3097 2.3097 2.5879 2.5879 3.4011 3.4011 3.4448 3.4448 3.7902 3.7902 7.4773 7.4773 12.7421 12.7421 13.5365 13.5365 13.8297 13.8297 17.1930 17.1930 k = 0.0000 0.1176-0.0000 ( 2788 PWs) bands (ev): -18.0575 -18.0575 -17.3637 -17.3637 -17.3061 -17.3061 -17.2400 -17.2400 -2.3776 -2.3776 -1.5556 -1.5556 -0.7994 -0.7994 -0.7612 -0.7612 -0.6985 -0.6985 0.2082 0.2082 0.2235 0.2235 0.4772 0.4772 0.6996 0.6996 0.7343 0.7343 0.8293 0.8293 0.9149 0.9149 1.0407 1.0407 1.3651 1.3651 1.7642 1.7642 2.1549 2.1549 2.1651 2.1651 2.3246 2.3246 2.5805 2.5805 3.3986 3.3986 3.4419 3.4419 3.7828 3.7828 7.5241 7.5241 12.6555 12.6555 13.5553 13.5553 13.8854 13.8854 17.1561 17.1561 k = 0.0000 0.1324-0.0000 ( 2796 PWs) bands (ev): -18.0519 -18.0519 -17.3742 -17.3742 -17.3049 -17.3049 -17.2371 -17.2371 -2.3597 -2.3597 -1.5496 -1.5496 -0.7977 -0.7977 -0.7603 -0.7603 -0.6885 -0.6885 0.1723 0.1723 0.1883 0.1883 0.4649 0.4649 0.6938 0.6938 0.7319 0.7319 0.8451 0.8451 0.9327 0.9327 1.0533 1.0533 1.3772 1.3772 1.7663 1.7663 2.1346 2.1346 2.1609 2.1609 2.3416 2.3416 2.5722 2.5722 3.3959 3.3959 3.4388 3.4388 3.7742 3.7742 7.5764 7.5764 12.5667 12.5667 13.5762 13.5762 13.9394 13.9394 17.1181 17.1181 k = 0.0000 0.1471-0.0000 ( 2800 PWs) bands (ev): -18.0457 -18.0457 -17.3853 -17.3853 -17.3036 -17.3036 -17.2344 -17.2344 -2.3400 -2.3400 -1.5430 -1.5430 -0.7959 -0.7959 -0.7594 -0.7594 -0.6773 -0.6773 0.1358 0.1358 0.1517 0.1517 0.4529 0.4529 0.6854 0.6854 0.7271 0.7271 0.8607 0.8607 0.9521 0.9521 1.0657 1.0657 1.3910 1.3910 1.7684 1.7684 2.1119 2.1119 2.1577 2.1577 2.3606 2.3606 2.5631 2.5631 3.3929 3.3929 3.4354 3.4354 3.7644 3.7644 7.6340 7.6340 12.4760 12.4760 13.5993 13.5993 13.9913 13.9913 17.0797 17.0797 k = 0.0000 0.1618-0.0000 ( 2798 PWs) bands (ev): -18.0388 -18.0388 -17.3969 -17.3969 -17.3021 -17.3021 -17.2321 -17.2321 -2.3182 -2.3182 -1.5358 -1.5358 -0.7941 -0.7941 -0.7583 -0.7583 -0.6650 -0.6650 0.0988 0.0988 0.1140 0.1140 0.4413 0.4413 0.6748 0.6748 0.7202 0.7202 0.8761 0.8761 0.9722 0.9722 1.0781 1.0781 1.4066 1.4066 1.7702 1.7702 2.0883 2.0883 2.1545 2.1545 2.3815 2.3815 2.5530 2.5530 3.3898 3.3898 3.4319 3.4319 3.7534 3.7534 7.6964 7.6964 12.3834 12.3834 13.6245 13.6245 14.0410 14.0410 17.0415 17.0415 k = 0.0000 0.1765-0.0000 ( 2796 PWs) bands (ev): -18.0313 -18.0313 -17.4089 -17.4089 -17.3005 -17.3005 -17.2301 -17.2301 -2.2946 -2.2946 -1.5282 -1.5282 -0.7921 -0.7921 -0.7573 -0.7573 -0.6515 -0.6515 0.0617 0.0617 0.0753 0.0753 0.4302 0.4302 0.6625 0.6625 0.7115 0.7115 0.8909 0.8909 0.9920 0.9920 1.0907 1.0907 1.4236 1.4236 1.7718 1.7718 2.0645 2.0645 2.1513 2.1513 2.4042 2.4042 2.5421 2.5421 3.3864 3.3864 3.4282 3.4282 3.7411 3.7411 7.7635 7.7635 12.2891 12.2891 13.6516 13.6516 14.0885 14.0885 17.0039 17.0039 k = 0.0000 0.1912-0.0000 ( 2796 PWs) bands (ev): -18.0232 -18.0232 -17.4214 -17.4214 -17.2988 -17.2988 -17.2284 -17.2284 -2.2693 -2.2693 -1.5200 -1.5200 -0.7900 -0.7900 -0.7562 -0.7562 -0.6370 -0.6370 0.0245 0.0245 0.0359 0.0359 0.4197 0.4197 0.6482 0.6482 0.7012 0.7012 0.9049 0.9049 1.0105 1.0105 1.1041 1.1041 1.4421 1.4421 1.7729 1.7729 2.0408 2.0408 2.1479 2.1479 2.4286 2.4286 2.5304 2.5304 3.3828 3.3828 3.4243 3.4243 3.7274 3.7274 7.8351 7.8351 12.1932 12.1932 13.6808 13.6808 14.1335 14.1335 16.9673 16.9673 k = 0.0000 0.2059-0.0000 ( 2794 PWs) bands (ev): -18.0146 -18.0146 -17.4344 -17.4344 -17.2969 -17.2969 -17.2270 -17.2270 -2.2422 -2.2422 -1.5115 -1.5115 -0.7879 -0.7879 -0.7550 -0.7550 -0.6215 -0.6215 -0.0125 -0.0125 -0.0040 -0.0040 0.4099 0.4099 0.6320 0.6320 0.6897 0.6897 0.9183 0.9183 1.0268 1.0268 1.1191 1.1191 1.4617 1.4617 1.7737 1.7737 2.0177 2.0177 2.1445 2.1445 2.4545 2.4545 2.5180 2.5180 3.3791 3.3791 3.4202 3.4202 3.7124 3.7124 7.9107 7.9107 12.0957 12.0957 13.7117 13.7117 14.1760 14.1760 16.9322 16.9322 k = 0.0000 0.2206-0.0000 ( 2798 PWs) bands (ev): -18.0053 -18.0053 -17.4477 -17.4477 -17.2950 -17.2950 -17.2259 -17.2259 -2.2134 -2.2134 -1.5027 -1.5027 -0.7858 -0.7858 -0.7539 -0.7539 -0.6051 -0.6051 -0.0497 -0.0497 -0.0437 -0.0437 0.4007 0.4007 0.6139 0.6139 0.6772 0.6772 0.9307 0.9307 1.0401 1.0401 1.1363 1.1363 1.4822 1.4822 1.7738 1.7738 1.9954 1.9954 2.1410 2.1410 2.4815 2.4815 2.5052 2.5052 3.3753 3.3753 3.4159 3.4159 3.6960 3.6960 7.9902 7.9902 11.9967 11.9967 13.7443 13.7443 14.2159 14.2159 16.8987 16.8987 k = 0.0000 0.2353-0.0000 ( 2794 PWs) bands (ev): -17.9955 -17.9955 -17.4615 -17.4615 -17.2930 -17.2930 -17.2251 -17.2251 -2.1831 -2.1831 -1.4938 -1.4938 -0.7835 -0.7835 -0.7527 -0.7527 -0.5880 -0.5880 -0.0882 -0.0882 -0.0817 -0.0817 0.3923 0.3923 0.5939 0.5939 0.6639 0.6639 0.9424 0.9424 1.0502 1.0502 1.1560 1.1560 1.5033 1.5033 1.7734 1.7734 1.9743 1.9743 2.1376 2.1376 2.4895 2.4895 2.5122 2.5122 3.3715 3.3715 3.4117 3.4117 3.6782 3.6782 8.0733 8.0733 11.8963 11.8963 13.7785 13.7785 14.2531 14.2531 16.8671 16.8671 k = 0.0000 0.2500-0.0000 ( 2786 PWs) bands (ev): -17.9852 -17.9852 -17.4755 -17.4755 -17.2908 -17.2908 -17.2245 -17.2245 -2.1513 -2.1513 -1.4847 -1.4847 -0.7812 -0.7812 -0.7515 -0.7515 -0.5702 -0.5702 -0.1283 -0.1283 -0.1171 -0.1171 0.3847 0.3847 0.5721 0.5721 0.6500 0.6500 0.9531 0.9531 1.0575 1.0575 1.1779 1.1779 1.5249 1.5249 1.7724 1.7724 1.9546 1.9546 2.1342 2.1342 2.4754 2.4754 2.5419 2.5419 3.3677 3.3677 3.4074 3.4074 3.6591 3.6591 8.1597 8.1597 11.7946 11.7946 13.8140 13.8140 14.2877 14.2877 16.8377 16.8377 k = 0.0000 0.2647-0.0000 ( 2790 PWs) bands (ev): -17.9744 -17.9744 -17.4900 -17.4900 -17.2886 -17.2886 -17.2243 -17.2243 -2.1181 -2.1181 -1.4756 -1.4756 -0.7790 -0.7790 -0.7504 -0.7504 -0.5521 -0.5521 -0.1690 -0.1690 -0.1506 -0.1506 0.3779 0.3779 0.5484 0.5484 0.6355 0.6355 0.9630 0.9630 1.0624 1.0624 1.2013 1.2013 1.5465 1.5465 1.7706 1.7706 1.9364 1.9364 2.1310 2.1310 2.4602 2.4602 2.5733 2.5733 3.3639 3.3639 3.4030 3.4030 3.6387 3.6387 8.2492 8.2492 11.6916 11.6916 13.8508 13.8508 14.3195 14.3195 16.8107 16.8107 k = 0.0000 0.2794-0.0000 ( 2790 PWs) bands (ev): -17.9630 -17.9630 -17.5047 -17.5047 -17.2863 -17.2863 -17.2243 -17.2243 -2.0836 -2.0836 -1.4668 -1.4668 -0.7767 -0.7767 -0.7494 -0.7494 -0.5341 -0.5341 -0.2095 -0.2095 -0.1821 -0.1821 0.3718 0.3718 0.5229 0.5229 0.6207 0.6207 0.9721 0.9721 1.0655 1.0655 1.2258 1.2258 1.5679 1.5679 1.7682 1.7682 1.9199 1.9199 2.1279 2.1279 2.4443 2.4443 2.6058 2.6058 3.3602 3.3602 3.3986 3.3986 3.6169 3.6169 8.3415 8.3415 11.5874 11.5874 13.8886 13.8886 14.3485 14.3485 16.7862 16.7862 k = 0.0000 0.2941-0.0000 ( 2794 PWs) bands (ev): -17.9512 -17.9512 -17.5198 -17.5198 -17.2839 -17.2839 -17.2246 -17.2246 -2.0479 -2.0479 -1.4583 -1.4583 -0.7745 -0.7745 -0.7485 -0.7485 -0.5168 -0.5168 -0.2495 -0.2495 -0.2109 -0.2109 0.3663 0.3663 0.4959 0.4959 0.6056 0.6056 0.9805 0.9805 1.0672 1.0672 1.2510 1.2510 1.5889 1.5889 1.7651 1.7651 1.9051 1.9051 2.1252 2.1252 2.4279 2.4279 2.6394 2.6394 3.3566 3.3566 3.3942 3.3942 3.5939 3.5939 8.4365 8.4365 11.4821 11.4821 13.9273 13.9273 14.3746 14.3746 16.7644 16.7644 k = 0.0000 0.3088-0.0000 ( 2786 PWs) bands (ev): -17.9389 -17.9389 -17.5351 -17.5351 -17.2814 -17.2814 -17.2250 -17.2250 -2.0113 -2.0113 -1.4504 -1.4504 -0.7721 -0.7721 -0.7475 -0.7475 -0.5013 -0.5013 -0.2887 -0.2887 -0.2361 -0.2361 0.3613 0.3613 0.4678 0.4678 0.5904 0.5904 0.9881 0.9881 1.0680 1.0680 1.2767 1.2767 1.6092 1.6092 1.7615 1.7615 1.8919 1.8919 2.1230 2.1230 2.4110 2.4110 2.6739 2.6739 3.3533 3.3533 3.3898 3.3898 3.5697 3.5697 8.5338 8.5338 11.3757 11.3757 13.9665 13.9665 14.3977 14.3977 16.7455 16.7455 k = 0.0000 0.3235-0.0000 ( 2790 PWs) bands (ev): -17.9261 -17.9261 -17.5507 -17.5507 -17.2789 -17.2789 -17.2258 -17.2258 -1.9738 -1.9738 -1.4433 -1.4433 -0.7699 -0.7699 -0.7468 -0.7468 -0.4892 -0.4892 -0.3267 -0.3267 -0.2560 -0.2560 0.3560 0.3560 0.4393 0.4393 0.5752 0.5752 0.9951 0.9951 1.0680 1.0680 1.3025 1.3025 1.6283 1.6283 1.7576 1.7576 1.8804 1.8804 2.1211 2.1211 2.3937 2.3937 2.7091 2.7091 3.3501 3.3501 3.3854 3.3854 3.5443 3.5443 8.6333 8.6333 11.2684 11.2684 14.0061 14.0061 14.4179 14.4179 16.7296 16.7296 k = 0.0000 0.3382-0.0000 ( 2786 PWs) bands (ev): -17.9129 -17.9129 -17.5664 -17.5664 -17.2764 -17.2764 -17.2267 -17.2267 -1.9355 -1.9355 -1.4373 -1.4373 -0.7676 -0.7676 -0.7461 -0.7461 -0.4825 -0.4825 -0.3631 -0.3631 -0.2684 -0.2684 0.3487 0.3487 0.4124 0.4124 0.5600 0.5600 1.0015 1.0015 1.0674 1.0674 1.3283 1.3283 1.6456 1.6456 1.7537 1.7537 1.8705 1.8705 2.1200 2.1200 2.3761 2.3761 2.7451 2.7451 3.3472 3.3472 3.3812 3.3812 3.5177 3.5177 8.7348 8.7348 11.1601 11.1601 14.0458 14.0458 14.4350 14.4350 16.7168 16.7168 k = 0.0000 0.3529-0.0000 ( 2786 PWs) bands (ev): -17.8993 -17.8993 -17.5824 -17.5824 -17.2738 -17.2738 -17.2278 -17.2278 -1.8967 -1.8967 -1.4327 -1.4327 -0.7654 -0.7654 -0.7455 -0.7455 -0.4831 -0.4831 -0.3975 -0.3975 -0.2715 -0.2715 0.3352 0.3352 0.3914 0.3914 0.5450 0.5450 1.0073 1.0073 1.0664 1.0664 1.3540 1.3540 1.6604 1.6604 1.7505 1.7505 1.8619 1.8619 2.1197 2.1197 2.3582 2.3582 2.7816 2.7816 3.3445 3.3445 3.3769 3.3769 3.4902 3.4902 8.8381 8.8381 11.0511 11.0511 14.0854 14.0854 14.4489 14.4489 16.7074 16.7074 k = 0.0000 0.3676-0.0000 ( 2784 PWs) bands (ev): -17.8854 -17.8854 -17.5986 -17.5986 -17.2711 -17.2711 -17.2291 -17.2291 -1.8576 -1.8576 -1.4299 -1.4299 -0.7631 -0.7631 -0.7451 -0.7451 -0.4913 -0.4913 -0.4293 -0.4293 -0.2649 -0.2649 0.3117 0.3117 0.3803 0.3803 0.5302 0.5302 1.0127 1.0127 1.0650 1.0650 1.3794 1.3794 1.6711 1.6711 1.7493 1.7493 1.8545 1.8545 2.1203 2.1203 2.3401 2.3401 2.8185 2.8185 3.3420 3.3420 3.3727 3.3727 3.4617 3.4617 8.9430 8.9430 10.9412 10.9412 14.1244 14.1244 14.4597 14.4597 16.7014 16.7014 k = 0.0000 0.3824-0.0000 ( 2786 PWs) bands (ev): -17.8710 -17.8710 -17.6148 -17.6148 -17.2684 -17.2684 -17.2306 -17.2306 -1.8184 -1.8184 -1.4292 -1.4292 -0.7611 -0.7611 -0.7448 -0.7448 -0.5055 -0.5055 -0.4583 -0.4583 -0.2502 -0.2502 0.2810 0.2810 0.3765 0.3765 0.5156 0.5156 1.0175 1.0175 1.0634 1.0634 1.4045 1.4045 1.6762 1.6762 1.7514 1.7514 1.8482 1.8482 2.1221 2.1221 2.3219 2.3219 2.8558 2.8558 3.3394 3.3394 3.3686 3.3686 3.4327 3.4327 9.0493 9.0493 10.8307 10.8307 14.1628 14.1628 14.4672 14.4672 16.6991 16.6991 k = 0.0000 0.3971-0.0000 ( 2788 PWs) bands (ev): -17.8564 -17.8564 -17.6312 -17.6312 -17.2658 -17.2658 -17.2323 -17.2323 -1.7793 -1.7793 -1.4310 -1.4310 -0.7591 -0.7591 -0.7447 -0.7447 -0.5228 -0.5228 -0.4843 -0.4843 -0.2294 -0.2294 0.2469 0.2469 0.3765 0.3765 0.5014 0.5014 1.0220 1.0220 1.0616 1.0616 1.4292 1.4292 1.6752 1.6752 1.7572 1.7572 1.8428 1.8428 2.1251 2.1251 2.3037 2.3037 2.8934 2.8934 3.3364 3.3364 3.3645 3.3645 3.4037 3.4037 9.1569 9.1569 10.7196 10.7196 14.2001 14.2001 14.4715 14.4715 16.7005 16.7005 k = 0.0000 0.4118-0.0000 ( 2784 PWs) bands (ev): -17.8414 -17.8414 -17.6477 -17.6477 -17.2631 -17.2631 -17.2341 -17.2341 -1.7407 -1.7407 -1.4358 -1.4358 -0.7571 -0.7571 -0.7447 -0.7447 -0.5407 -0.5407 -0.5075 -0.5075 -0.2043 -0.2043 0.2111 0.2111 0.3787 0.3787 0.4877 0.4877 1.0262 1.0262 1.0597 1.0597 1.4534 1.4534 1.6692 1.6692 1.7656 1.7656 1.8381 1.8381 2.1294 2.1294 2.2856 2.2856 2.9311 2.9311 3.3310 3.3310 3.3599 3.3599 3.3773 3.3773 9.2655 9.2655 10.6080 10.6080 14.2360 14.2360 14.4724 14.4724 16.7057 16.7057 k = 0.0000 0.4265-0.0000 ( 2772 PWs) bands (ev): -17.8262 -17.8262 -17.6642 -17.6642 -17.2604 -17.2604 -17.2360 -17.2360 -1.7027 -1.7027 -1.4437 -1.4437 -0.7551 -0.7551 -0.7448 -0.7448 -0.5573 -0.5573 -0.5280 -0.5280 -0.1762 -0.1762 0.1745 0.1745 0.3824 0.3824 0.4746 0.4746 1.0301 1.0301 1.0577 1.0577 1.4769 1.4769 1.6597 1.6597 1.7749 1.7749 1.8339 1.8339 2.1353 2.1353 2.2678 2.2678 2.9689 2.9689 3.3171 3.3171 3.3526 3.3526 3.3619 3.3619 9.3752 9.3752 10.4960 10.4960 14.2703 14.2703 14.4700 14.4700 16.7149 16.7149 k = 0.0000 0.4412-0.0000 ( 2768 PWs) bands (ev): -17.8107 -17.8107 -17.6808 -17.6808 -17.2577 -17.2577 -17.2381 -17.2381 -1.6659 -1.6659 -1.4552 -1.4552 -0.7534 -0.7534 -0.7451 -0.7451 -0.5712 -0.5712 -0.5461 -0.5461 -0.1458 -0.1458 0.1374 0.1374 0.3874 0.3874 0.4619 0.4619 1.0337 1.0337 1.0556 1.0556 1.4998 1.4998 1.6476 1.6476 1.7841 1.7841 1.8300 1.8300 2.1428 2.1428 2.2504 2.2504 3.0065 3.0065 3.2911 3.2911 3.3470 3.3470 3.3567 3.3567 9.4857 9.4857 10.3837 10.3837 14.3026 14.3026 14.4641 14.4641 16.7282 16.7282 k = 0.0000 0.4559-0.0000 ( 2776 PWs) bands (ev): -17.7949 -17.7949 -17.6973 -17.6973 -17.2551 -17.2551 -17.2403 -17.2403 -1.6305 -1.6305 -1.4703 -1.4703 -0.7519 -0.7519 -0.7457 -0.7457 -0.5817 -0.5817 -0.5615 -0.5615 -0.1137 -0.1137 0.1001 0.1001 0.3936 0.3936 0.4498 0.4498 1.0369 1.0369 1.0532 1.0532 1.5219 1.5219 1.6336 1.6336 1.7926 1.7926 1.8260 1.8260 2.1517 2.1517 2.2334 2.2334 3.0441 3.0441 3.2594 3.2594 3.3451 3.3451 3.3534 3.3534 9.5968 9.5968 10.2711 10.2711 14.3328 14.3328 14.4549 14.4549 16.7456 16.7456 k = 0.0000 0.4706-0.0000 ( 2784 PWs) bands (ev): -17.7790 -17.7790 -17.7138 -17.7138 -17.2524 -17.2524 -17.2425 -17.2425 -1.5970 -1.5970 -1.4890 -1.4890 -0.7505 -0.7505 -0.7464 -0.7464 -0.5882 -0.5882 -0.5740 -0.5740 -0.0802 -0.0802 0.0630 0.0630 0.4007 0.4007 0.4384 0.4384 1.0399 1.0399 1.0508 1.0508 1.5431 1.5431 1.6179 1.6179 1.8002 1.8002 1.8220 1.8220 2.1622 2.1622 2.2171 2.2171 3.0813 3.0813 3.2255 3.2255 3.3448 3.3448 3.3507 3.3507 9.7085 9.7085 10.1584 10.1584 14.3604 14.3604 14.4424 14.4424 16.7671 16.7671 k = 0.0000 0.4853-0.0000 ( 2784 PWs) bands (ev): -17.7629 -17.7629 -17.7303 -17.7303 -17.2499 -17.2499 -17.2449 -17.2449 -1.5657 -1.5657 -1.5113 -1.5113 -0.7492 -0.7492 -0.7472 -0.7472 -0.5905 -0.5905 -0.5832 -0.5832 -0.0456 -0.0456 0.0262 0.0262 0.4088 0.4088 0.4277 0.4277 1.0429 1.0429 1.0483 1.0483 1.5634 1.5634 1.6009 1.6009 1.8068 1.8068 1.8176 1.8176 2.1741 2.1741 2.2017 2.2017 3.1182 3.1182 3.1905 3.1905 3.3454 3.3454 3.3485 3.3485 9.8206 9.8206 10.0457 10.0457 14.3854 14.3854 14.4265 14.4265 16.7928 16.7928 k = 0.0000 0.5000-0.0000 ( 2776 PWs) bands (ev): -17.7467 -17.7467 -17.7467 -17.7467 -17.2473 -17.2473 -17.2473 -17.2473 -1.5370 -1.5370 -1.5370 -1.5370 -0.7481 -0.7481 -0.7481 -0.7481 -0.5887 -0.5887 -0.5887 -0.5887 -0.0100 -0.0100 -0.0100 -0.0100 0.4179 0.4179 0.4179 0.4179 1.0457 1.0457 1.0457 1.0457 1.5827 1.5827 1.5827 1.5827 1.8126 1.8126 1.8126 1.8126 2.1873 2.1873 2.1873 2.1873 3.1547 3.1547 3.1547 3.1547 3.3467 3.3467 3.3467 3.3467 9.9331 9.9331 9.9331 9.9331 14.4075 14.4075 14.4075 14.4075 16.8226 16.8226 k = 0.0000 0.5000-0.0000 ( 2776 PWs) bands (ev): -17.7467 -17.7467 -17.7467 -17.7467 -17.2473 -17.2473 -17.2473 -17.2473 -1.5370 -1.5370 -1.5370 -1.5370 -0.7481 -0.7481 -0.7481 -0.7481 -0.5887 -0.5887 -0.5887 -0.5887 -0.0100 -0.0100 -0.0100 -0.0100 0.4179 0.4179 0.4179 0.4179 1.0457 1.0457 1.0457 1.0457 1.5827 1.5827 1.5827 1.5827 1.8126 1.8126 1.8126 1.8126 2.1873 2.1873 2.1873 2.1873 3.1547 3.1547 3.1547 3.1547 3.3467 3.3467 3.3467 3.3467 9.9331 9.9331 9.9331 9.9331 14.4075 14.4075 14.4075 14.4075 16.8226 16.8226 k = 0.0147 0.5000-0.0000 ( 2786 PWs) bands (ev): -17.7465 -17.7465 -17.7465 -17.7465 -17.2475 -17.2475 -17.2475 -17.2475 -1.5387 -1.5387 -1.5387 -1.5387 -0.7483 -0.7483 -0.7483 -0.7483 -0.5864 -0.5864 -0.5864 -0.5864 -0.0093 -0.0093 -0.0093 -0.0093 0.4184 0.4184 0.4184 0.4184 1.0456 1.0456 1.0456 1.0456 1.5821 1.5821 1.5821 1.5821 1.8105 1.8105 1.8105 1.8105 2.1890 2.1890 2.1890 2.1890 3.1533 3.1533 3.1533 3.1533 3.3469 3.3469 3.3469 3.3469 9.9347 9.9347 9.9347 9.9347 14.4041 14.4041 14.4041 14.4041 16.8263 16.8263 k = 0.0294 0.5000-0.0000 ( 2786 PWs) bands (ev): -17.7460 -17.7460 -17.7460 -17.7460 -17.2481 -17.2481 -17.2481 -17.2481 -1.5436 -1.5436 -1.5436 -1.5436 -0.7488 -0.7488 -0.7488 -0.7488 -0.5794 -0.5794 -0.5794 -0.5794 -0.0072 -0.0072 -0.0072 -0.0072 0.4202 0.4202 0.4202 0.4202 1.0453 1.0453 1.0453 1.0453 1.5801 1.5801 1.5801 1.5801 1.8043 1.8043 1.8043 1.8043 2.1938 2.1938 2.1938 2.1938 3.1490 3.1490 3.1490 3.1490 3.3474 3.3474 3.3474 3.3474 9.9395 9.9395 9.9395 9.9395 14.3941 14.3941 14.3941 14.3941 16.8373 16.8373 k = 0.0441 0.5000-0.0000 ( 2782 PWs) bands (ev): -17.7452 -17.7452 -17.7452 -17.7452 -17.2490 -17.2490 -17.2490 -17.2490 -1.5516 -1.5516 -1.5516 -1.5516 -0.7495 -0.7495 -0.7495 -0.7495 -0.5678 -0.5678 -0.5678 -0.5678 -0.0037 -0.0037 -0.0037 -0.0037 0.4232 0.4232 0.4232 0.4232 1.0449 1.0449 1.0449 1.0449 1.5769 1.5769 1.5769 1.5769 1.7945 1.7945 1.7945 1.7945 2.2015 2.2015 2.2015 2.2015 3.1419 3.1419 3.1419 3.1419 3.3482 3.3482 3.3482 3.3482 9.9476 9.9476 9.9476 9.9476 14.3775 14.3775 14.3775 14.3775 16.8554 16.8554 k = 0.0588 0.5000-0.0000 ( 2782 PWs) bands (ev): -17.7440 -17.7440 -17.7440 -17.7440 -17.2503 -17.2503 -17.2503 -17.2503 -1.5624 -1.5624 -1.5624 -1.5624 -0.7506 -0.7506 -0.7506 -0.7506 -0.5522 -0.5522 -0.5522 -0.5522 0.0013 0.0013 0.0013 0.0013 0.4273 0.4273 0.4273 0.4273 1.0442 1.0442 1.0442 1.0442 1.5724 1.5724 1.5724 1.5724 1.7815 1.7815 1.7815 1.7815 2.2116 2.2116 2.2116 2.2116 3.1320 3.1320 3.1320 3.1320 3.3494 3.3494 3.3494 3.3494 9.9587 9.9587 9.9587 9.9587 14.3548 14.3548 14.3548 14.3548 16.8803 16.8803 k = 0.0735 0.5000-0.0000 ( 2780 PWs) bands (ev): -17.7425 -17.7425 -17.7425 -17.7425 -17.2519 -17.2519 -17.2519 -17.2519 -1.5757 -1.5757 -1.5757 -1.5757 -0.7519 -0.7519 -0.7519 -0.7519 -0.5327 -0.5327 -0.5327 -0.5327 0.0077 0.0077 0.0077 0.0077 0.4326 0.4326 0.4326 0.4326 1.0433 1.0433 1.0433 1.0433 1.5667 1.5667 1.5667 1.5667 1.7659 1.7659 1.7659 1.7659 2.2236 2.2236 2.2236 2.2236 3.1194 3.1194 3.1194 3.1194 3.3508 3.3508 3.3508 3.3508 9.9730 9.9730 9.9730 9.9730 14.3264 14.3264 14.3264 14.3264 16.9116 16.9116 k = 0.0882 0.5000-0.0000 ( 2788 PWs) bands (ev): -17.7406 -17.7406 -17.7406 -17.7406 -17.2539 -17.2539 -17.2539 -17.2539 -1.5912 -1.5912 -1.5912 -1.5912 -0.7535 -0.7535 -0.7535 -0.7535 -0.5099 -0.5099 -0.5099 -0.5099 0.0154 0.0154 0.0154 0.0154 0.4390 0.4390 0.4390 0.4390 1.0422 1.0422 1.0422 1.0422 1.5597 1.5597 1.5597 1.5597 1.7481 1.7481 1.7481 1.7481 2.2369 2.2369 2.2369 2.2369 3.1041 3.1041 3.1041 3.1041 3.3525 3.3525 3.3525 3.3525 9.9903 9.9903 9.9903 9.9903 14.2926 14.2926 14.2926 14.2926 16.9488 16.9488 k = 0.1029 0.5000-0.0000 ( 2788 PWs) bands (ev): -17.7385 -17.7385 -17.7385 -17.7385 -17.2562 -17.2562 -17.2562 -17.2562 -1.6084 -1.6084 -1.6084 -1.6084 -0.7553 -0.7553 -0.7553 -0.7553 -0.4841 -0.4841 -0.4841 -0.4841 0.0245 0.0245 0.0245 0.0245 0.4465 0.4465 0.4465 0.4465 1.0407 1.0407 1.0407 1.0407 1.5515 1.5515 1.5515 1.5515 1.7288 1.7288 1.7288 1.7288 2.2513 2.2513 2.2513 2.2513 3.0863 3.0863 3.0863 3.0863 3.3546 3.3546 3.3546 3.3546 10.0105 10.0105 10.0105 10.0105 14.2540 14.2540 14.2540 14.2540 16.9915 16.9915 k = 0.1176 0.5000-0.0000 ( 2790 PWs) bands (ev): -17.7361 -17.7361 -17.7361 -17.7361 -17.2588 -17.2588 -17.2588 -17.2588 -1.6270 -1.6270 -1.6270 -1.6270 -0.7574 -0.7574 -0.7574 -0.7574 -0.4559 -0.4559 -0.4559 -0.4559 0.0351 0.0351 0.0351 0.0351 0.4551 0.4551 0.4551 0.4551 1.0389 1.0389 1.0389 1.0389 1.5422 1.5422 1.5422 1.5422 1.7084 1.7084 1.7084 1.7084 2.2663 2.2663 2.2663 2.2663 3.0659 3.0659 3.0659 3.0659 3.3568 3.3568 3.3568 3.3568 10.0335 10.0335 10.0335 10.0335 14.2111 14.2111 14.2111 14.2111 17.0392 17.0392 k = 0.1324 0.5000-0.0000 ( 2790 PWs) bands (ev): -17.7333 -17.7333 -17.7333 -17.7333 -17.2618 -17.2618 -17.2618 -17.2618 -1.6467 -1.6467 -1.6467 -1.6467 -0.7595 -0.7595 -0.7595 -0.7595 -0.4255 -0.4255 -0.4255 -0.4255 0.0471 0.0471 0.0471 0.0471 0.4647 0.4647 0.4647 0.4647 1.0367 1.0367 1.0367 1.0367 1.5317 1.5317 1.5317 1.5317 1.6872 1.6872 1.6872 1.6872 2.2816 2.2816 2.2816 2.2816 3.0432 3.0432 3.0432 3.0432 3.3594 3.3594 3.3594 3.3594 10.0592 10.0592 10.0592 10.0592 14.1644 14.1644 14.1644 14.1644 17.0913 17.0913 k = 0.1471 0.5000-0.0000 ( 2796 PWs) bands (ev): -17.7303 -17.7303 -17.7303 -17.7303 -17.2650 -17.2650 -17.2650 -17.2650 -1.6671 -1.6671 -1.6671 -1.6671 -0.7620 -0.7620 -0.7620 -0.7620 -0.3935 -0.3935 -0.3935 -0.3935 0.0605 0.0605 0.0605 0.0605 0.4753 0.4753 0.4753 0.4753 1.0339 1.0339 1.0339 1.0339 1.5201 1.5201 1.5201 1.5201 1.6657 1.6657 1.6657 1.6657 2.2970 2.2970 2.2970 2.2970 3.0181 3.0181 3.0181 3.0181 3.3620 3.3620 3.3620 3.3620 10.0874 10.0874 10.0874 10.0874 14.1144 14.1144 14.1144 14.1144 17.1473 17.1473 k = 0.1618 0.5000-0.0000 ( 2800 PWs) bands (ev): -17.7270 -17.7270 -17.7270 -17.7270 -17.2686 -17.2686 -17.2686 -17.2686 -1.6880 -1.6880 -1.6880 -1.6880 -0.7645 -0.7645 -0.7645 -0.7645 -0.3602 -0.3602 -0.3602 -0.3602 0.0753 0.0753 0.0753 0.0753 0.4868 0.4868 0.4868 0.4868 1.0307 1.0307 1.0307 1.0307 1.5076 1.5076 1.5076 1.5076 1.6442 1.6442 1.6442 1.6442 2.3123 2.3123 2.3123 2.3123 2.9910 2.9910 2.9910 2.9910 3.3648 3.3648 3.3648 3.3648 10.1180 10.1180 10.1180 10.1180 14.0617 14.0617 14.0617 14.0617 17.2067 17.2067 k = 0.1765 0.5000-0.0000 ( 2800 PWs) bands (ev): -17.7235 -17.7235 -17.7235 -17.7235 -17.2724 -17.2724 -17.2724 -17.2724 -1.7090 -1.7090 -1.7090 -1.7090 -0.7671 -0.7671 -0.7671 -0.7671 -0.3259 -0.3259 -0.3259 -0.3259 0.0915 0.0915 0.0915 0.0915 0.4993 0.4993 0.4993 0.4993 1.0267 1.0267 1.0267 1.0267 1.4941 1.4941 1.4941 1.4941 1.6230 1.6230 1.6230 1.6230 2.3274 2.3274 2.3274 2.3274 2.9618 2.9618 2.9618 2.9618 3.3678 3.3678 3.3678 3.3678 10.1509 10.1509 10.1509 10.1509 14.0067 14.0067 14.0067 14.0067 17.2690 17.2690 k = 0.1912 0.5000-0.0000 ( 2808 PWs) bands (ev): -17.7197 -17.7197 -17.7197 -17.7197 -17.2764 -17.2764 -17.2764 -17.2764 -1.7302 -1.7302 -1.7302 -1.7302 -0.7699 -0.7699 -0.7699 -0.7699 -0.2910 -0.2910 -0.2910 -0.2910 0.1090 0.1090 0.1090 0.1090 0.5126 0.5126 0.5126 0.5126 1.0219 1.0219 1.0219 1.0219 1.4797 1.4797 1.4797 1.4797 1.6024 1.6024 1.6024 1.6024 2.3420 2.3420 2.3420 2.3420 2.9308 2.9308 2.9308 2.9308 3.3709 3.3709 3.3709 3.3709 10.1858 10.1858 10.1858 10.1858 13.9498 13.9498 13.9498 13.9498 17.3338 17.3338 k = 0.2059 0.5000-0.0000 ( 2812 PWs) bands (ev): -17.7158 -17.7158 -17.7158 -17.7158 -17.2807 -17.2807 -17.2807 -17.2807 -1.7511 -1.7511 -1.7511 -1.7511 -0.7727 -0.7727 -0.7727 -0.7727 -0.2557 -0.2557 -0.2557 -0.2557 0.1277 0.1277 0.1277 0.1277 0.5267 0.5267 0.5267 0.5267 1.0161 1.0161 1.0161 1.0161 1.4647 1.4647 1.4647 1.4647 1.5827 1.5827 1.5827 1.5827 2.3561 2.3561 2.3561 2.3561 2.8981 2.8981 2.8981 2.8981 3.3741 3.3741 3.3741 3.3741 10.2225 10.2225 10.2225 10.2225 13.8914 13.8914 13.8914 13.8914 17.4005 17.4005 k = 0.2206 0.5000-0.0000 ( 2808 PWs) bands (ev): -17.7116 -17.7116 -17.7116 -17.7116 -17.2852 -17.2852 -17.2852 -17.2852 -1.7716 -1.7716 -1.7716 -1.7716 -0.7755 -0.7755 -0.7755 -0.7755 -0.2203 -0.2203 -0.2203 -0.2203 0.1477 0.1477 0.1477 0.1477 0.5416 0.5416 0.5416 0.5416 1.0094 1.0094 1.0094 1.0094 1.4490 1.4490 1.4490 1.4490 1.5643 1.5643 1.5643 1.5643 2.3695 2.3695 2.3695 2.3695 2.8640 2.8640 2.8640 2.8640 3.3774 3.3774 3.3774 3.3774 10.2608 10.2608 10.2608 10.2608 13.8320 13.8320 13.8320 13.8320 17.4688 17.4688 k = 0.2353 0.5000-0.0000 ( 2804 PWs) bands (ev): -17.7072 -17.7072 -17.7072 -17.7072 -17.2898 -17.2898 -17.2898 -17.2898 -1.7917 -1.7917 -1.7917 -1.7917 -0.7783 -0.7783 -0.7783 -0.7783 -0.1850 -0.1850 -0.1850 -0.1850 0.1687 0.1687 0.1687 0.1687 0.5572 0.5572 0.5572 0.5572 1.0015 1.0015 1.0015 1.0015 1.4328 1.4328 1.4328 1.4328 1.5473 1.5473 1.5473 1.5473 2.3821 2.3821 2.3821 2.3821 2.8286 2.8286 2.8286 2.8286 3.3807 3.3807 3.3807 3.3807 10.3006 10.3006 10.3006 10.3006 13.7719 13.7719 13.7719 13.7719 17.5381 17.5381 k = 0.2500 0.5000-0.0000 ( 2812 PWs) bands (ev): -17.7028 -17.7028 -17.7028 -17.7028 -17.2946 -17.2946 -17.2946 -17.2946 -1.8111 -1.8111 -1.8111 -1.8111 -0.7812 -0.7812 -0.7812 -0.7812 -0.1501 -0.1501 -0.1501 -0.1501 0.1906 0.1906 0.1906 0.1906 0.5732 0.5732 0.5732 0.5732 0.9922 0.9922 0.9922 0.9922 1.4161 1.4161 1.4161 1.4161 1.5321 1.5321 1.5321 1.5321 2.3938 2.3938 2.3938 2.3938 2.7923 2.7923 2.7923 2.7923 3.3840 3.3840 3.3840 3.3840 10.3415 10.3415 10.3415 10.3415 13.7115 13.7115 13.7115 13.7115 17.6080 17.6080 k = 0.2647 0.5000-0.0000 ( 2808 PWs) bands (ev): -17.6982 -17.6982 -17.6982 -17.6982 -17.2994 -17.2994 -17.2994 -17.2994 -1.8299 -1.8299 -1.8299 -1.8299 -0.7840 -0.7840 -0.7840 -0.7840 -0.1156 -0.1156 -0.1156 -0.1156 0.2134 0.2134 0.2134 0.2134 0.5898 0.5898 0.5898 0.5898 0.9817 0.9817 0.9817 0.9817 1.3991 1.3991 1.3991 1.3991 1.5191 1.5191 1.5191 1.5191 2.4044 2.4044 2.4044 2.4044 2.7554 2.7554 2.7554 2.7554 3.3873 3.3873 3.3873 3.3873 10.3833 10.3833 10.3833 10.3833 13.6512 13.6512 13.6512 13.6512 17.6780 17.6780 k = 0.2794 0.5000-0.0000 ( 2806 PWs) bands (ev): -17.6936 -17.6936 -17.6936 -17.6936 -17.3044 -17.3044 -17.3044 -17.3044 -1.8478 -1.8478 -1.8478 -1.8478 -0.7868 -0.7868 -0.7868 -0.7868 -0.0817 -0.0817 -0.0817 -0.0817 0.2367 0.2367 0.2367 0.2367 0.6067 0.6067 0.6067 0.6067 0.9697 0.9697 0.9697 0.9697 1.3816 1.3816 1.3816 1.3816 1.5084 1.5084 1.5084 1.5084 2.4136 2.4136 2.4136 2.4136 2.7183 2.7183 2.7183 2.7183 3.3905 3.3905 3.3905 3.3905 10.4256 10.4256 10.4256 10.4256 13.5912 13.5912 13.5912 13.5912 17.7475 17.7475 k = 0.2941 0.5000-0.0000 ( 2810 PWs) bands (ev): -17.6889 -17.6889 -17.6889 -17.6889 -17.3093 -17.3093 -17.3093 -17.3093 -1.8649 -1.8649 -1.8649 -1.8649 -0.7895 -0.7895 -0.7895 -0.7895 -0.0487 -0.0487 -0.0487 -0.0487 0.2604 0.2604 0.2604 0.2604 0.6238 0.6238 0.6238 0.6238 0.9563 0.9563 0.9563 0.9563 1.3638 1.3638 1.3638 1.3638 1.5004 1.5004 1.5004 1.5004 2.4210 2.4210 2.4210 2.4210 2.6816 2.6816 2.6816 2.6816 3.3936 3.3936 3.3936 3.3936 10.4683 10.4683 10.4683 10.4683 13.5321 13.5321 13.5321 13.5321 17.8161 17.8161 k = 0.3088 0.5000-0.0000 ( 2810 PWs) bands (ev): -17.6842 -17.6842 -17.6842 -17.6842 -17.3143 -17.3143 -17.3143 -17.3143 -1.8811 -1.8811 -1.8811 -1.8811 -0.7921 -0.7921 -0.7921 -0.7921 -0.0164 -0.0164 -0.0164 -0.0164 0.2841 0.2841 0.2841 0.2841 0.6410 0.6410 0.6410 0.6410 0.9417 0.9417 0.9417 0.9417 1.3458 1.3458 1.3458 1.3458 1.4952 1.4952 1.4952 1.4952 2.4261 2.4261 2.4261 2.4261 2.6462 2.6462 2.6462 2.6462 3.3967 3.3967 3.3967 3.3967 10.5109 10.5109 10.5109 10.5109 13.4741 13.4741 13.4741 13.4741 17.8831 17.8831 k = 0.3235 0.5000-0.0000 ( 2812 PWs) bands (ev): -17.6796 -17.6796 -17.6796 -17.6796 -17.3192 -17.3192 -17.3192 -17.3192 -1.8963 -1.8963 -1.8963 -1.8963 -0.7946 -0.7946 -0.7946 -0.7946 0.0149 0.0149 0.0149 0.0149 0.3076 0.3076 0.3076 0.3076 0.6579 0.6579 0.6579 0.6579 0.9262 0.9262 0.9262 0.9262 1.3274 1.3274 1.3274 1.3274 1.4928 1.4928 1.4928 1.4928 2.4276 2.4276 2.4276 2.4276 2.6134 2.6134 2.6134 2.6134 3.3996 3.3996 3.3996 3.3996 10.5530 10.5530 10.5530 10.5530 13.4176 13.4176 13.4176 13.4176 17.9480 17.9480 k = 0.3382 0.5000-0.0000 ( 2816 PWs) bands (ev): -17.6750 -17.6750 -17.6750 -17.6750 -17.3241 -17.3241 -17.3241 -17.3241 -1.9103 -1.9103 -1.9103 -1.9103 -0.7969 -0.7969 -0.7969 -0.7969 0.0453 0.0453 0.0453 0.0453 0.3305 0.3305 0.3305 0.3305 0.6742 0.6742 0.6742 0.6742 0.9102 0.9102 0.9102 0.9102 1.3089 1.3089 1.3089 1.3089 1.4933 1.4933 1.4933 1.4933 2.4241 2.4241 2.4241 2.4241 2.5850 2.5850 2.5850 2.5850 3.4022 3.4022 3.4022 3.4022 10.5944 10.5944 10.5944 10.5944 13.3631 13.3631 13.3631 13.3631 18.0101 18.0101 k = 0.3529 0.5000-0.0000 ( 2812 PWs) bands (ev): -17.6706 -17.6706 -17.6706 -17.6706 -17.3287 -17.3287 -17.3287 -17.3287 -1.9233 -1.9233 -1.9233 -1.9233 -0.7991 -0.7991 -0.7991 -0.7991 0.0746 0.0746 0.0746 0.0746 0.3527 0.3527 0.3527 0.3527 0.6895 0.6895 0.6895 0.6895 0.8943 0.8943 0.8943 0.8943 1.2904 1.2904 1.2904 1.2904 1.4964 1.4964 1.4964 1.4964 2.4137 2.4137 2.4137 2.4137 2.5633 2.5633 2.5633 2.5633 3.4048 3.4048 3.4048 3.4048 10.6346 10.6346 10.6346 10.6346 13.3110 13.3110 13.3110 13.3110 18.0690 18.0690 k = 0.3676 0.5000-0.0000 ( 2810 PWs) bands (ev): -17.6664 -17.6664 -17.6664 -17.6664 -17.3332 -17.3332 -17.3332 -17.3332 -1.9352 -1.9352 -1.9352 -1.9352 -0.8011 -0.8011 -0.8011 -0.8011 0.1027 0.1027 0.1027 0.1027 0.3738 0.3738 0.3738 0.3738 0.7030 0.7030 0.7030 0.7030 0.8793 0.8793 0.8793 0.8793 1.2720 1.2720 1.2720 1.2720 1.5021 1.5021 1.5021 1.5021 2.3957 2.3957 2.3957 2.3957 2.5493 2.5493 2.5493 2.5493 3.4072 3.4072 3.4072 3.4072 10.6731 10.6731 10.6731 10.6731 13.2617 13.2617 13.2617 13.2617 18.1241 18.1241 k = 0.3824 0.5000-0.0000 ( 2814 PWs) bands (ev): -17.6624 -17.6624 -17.6624 -17.6624 -17.3374 -17.3374 -17.3374 -17.3374 -1.9459 -1.9459 -1.9459 -1.9459 -0.8030 -0.8030 -0.8030 -0.8030 0.1295 0.1295 0.1295 0.1295 0.3934 0.3934 0.3934 0.3934 0.7136 0.7136 0.7136 0.7136 0.8665 0.8665 0.8665 0.8665 1.2539 1.2539 1.2539 1.2539 1.5098 1.5098 1.5098 1.5098 2.3717 2.3717 2.3717 2.3717 2.5418 2.5418 2.5418 2.5418 3.4094 3.4094 3.4094 3.4094 10.7095 10.7095 10.7095 10.7095 13.2157 13.2157 13.2157 13.2157 18.1747 18.1747 k = 0.3971 0.5000-0.0000 ( 2820 PWs) bands (ev): -17.6587 -17.6587 -17.6587 -17.6587 -17.3413 -17.3413 -17.3413 -17.3413 -1.9554 -1.9554 -1.9554 -1.9554 -0.8047 -0.8047 -0.8047 -0.8047 0.1548 0.1548 0.1548 0.1548 0.4114 0.4114 0.4114 0.4114 0.7202 0.7202 0.7202 0.7202 0.8572 0.8572 0.8572 0.8572 1.2364 1.2364 1.2364 1.2364 1.5192 1.5192 1.5192 1.5192 2.3444 2.3444 2.3444 2.3444 2.5386 2.5386 2.5386 2.5386 3.4113 3.4113 3.4113 3.4113 10.7432 10.7432 10.7432 10.7432 13.1734 13.1734 13.1734 13.1734 18.2204 18.2204 k = 0.4118 0.5000-0.0000 ( 2832 PWs) bands (ev): -17.6554 -17.6554 -17.6554 -17.6554 -17.3448 -17.3448 -17.3448 -17.3448 -1.9637 -1.9637 -1.9637 -1.9637 -0.8063 -0.8063 -0.8063 -0.8063 0.1781 0.1781 0.1781 0.1781 0.4276 0.4276 0.4276 0.4276 0.7216 0.7216 0.7216 0.7216 0.8526 0.8526 0.8526 0.8526 1.2198 1.2198 1.2198 1.2198 1.5296 1.5296 1.5296 1.5296 2.3164 2.3164 2.3164 2.3164 2.5379 2.5379 2.5379 2.5379 3.4130 3.4130 3.4130 3.4130 10.7739 10.7739 10.7739 10.7739 13.1355 13.1355 13.1355 13.1355 18.2607 18.2607 k = 0.4265 0.5000-0.0000 ( 2828 PWs) bands (ev): -17.6524 -17.6524 -17.6524 -17.6524 -17.3479 -17.3479 -17.3479 -17.3479 -1.9707 -1.9707 -1.9707 -1.9707 -0.8075 -0.8075 -0.8075 -0.8075 0.1993 0.1993 0.1993 0.1993 0.4418 0.4418 0.4418 0.4418 0.7183 0.7183 0.7183 0.7183 0.8530 0.8530 0.8530 0.8530 1.2044 1.2044 1.2044 1.2044 1.5406 1.5406 1.5406 1.5406 2.2895 2.2895 2.2895 2.2895 2.5384 2.5384 2.5384 2.5384 3.4145 3.4145 3.4145 3.4145 10.8009 10.8009 10.8009 10.8009 13.1023 13.1023 13.1023 13.1023 18.2954 18.2954 k = 0.4412 0.5000-0.0000 ( 2836 PWs) bands (ev): -17.6499 -17.6499 -17.6499 -17.6499 -17.3505 -17.3505 -17.3505 -17.3505 -1.9765 -1.9765 -1.9765 -1.9765 -0.8086 -0.8086 -0.8086 -0.8086 0.2177 0.2177 0.2177 0.2177 0.4537 0.4537 0.4537 0.4537 0.7116 0.7116 0.7116 0.7116 0.8566 0.8566 0.8566 0.8566 1.1906 1.1906 1.1906 1.1906 1.5512 1.5512 1.5512 1.5512 2.2653 2.2653 2.2653 2.2653 2.5393 2.5393 2.5393 2.5393 3.4157 3.4157 3.4157 3.4157 10.8238 10.8238 10.8238 10.8238 13.0743 13.0743 13.0743 13.0743 18.3241 18.3241 k = 0.4559 0.5000-0.0000 ( 2828 PWs) bands (ev): -17.6479 -17.6479 -17.6479 -17.6479 -17.3526 -17.3526 -17.3526 -17.3526 -1.9810 -1.9810 -1.9810 -1.9810 -0.8094 -0.8094 -0.8094 -0.8094 0.2329 0.2329 0.2329 0.2329 0.4634 0.4634 0.4634 0.4634 0.7039 0.7039 0.7039 0.7039 0.8619 0.8619 0.8619 0.8619 1.1791 1.1791 1.1791 1.1791 1.5607 1.5607 1.5607 1.5607 2.2450 2.2450 2.2450 2.2450 2.5404 2.5404 2.5404 2.5404 3.4167 3.4167 3.4167 3.4167 10.8421 10.8421 10.8421 10.8421 13.0521 13.0521 13.0521 13.0521 18.3466 18.3466 k = 0.4706 0.5000-0.0000 ( 2828 PWs) bands (ev): -17.6465 -17.6465 -17.6465 -17.6465 -17.3541 -17.3541 -17.3541 -17.3541 -1.9842 -1.9842 -1.9842 -1.9842 -0.8100 -0.8100 -0.8100 -0.8100 0.2443 0.2443 0.2443 0.2443 0.4704 0.4704 0.4704 0.4704 0.6969 0.6969 0.6969 0.6969 0.8669 0.8669 0.8669 0.8669 1.1703 1.1703 1.1703 1.1703 1.5682 1.5682 1.5682 1.5682 2.2296 2.2296 2.2296 2.2296 2.5412 2.5412 2.5412 2.5412 3.4174 3.4174 3.4174 3.4174 10.8555 10.8555 10.8555 10.8555 13.0359 13.0359 13.0359 13.0359 18.3627 18.3627 k = 0.4853 0.5000-0.0000 ( 2828 PWs) bands (ev): -17.6456 -17.6456 -17.6456 -17.6456 -17.3550 -17.3550 -17.3550 -17.3550 -1.9862 -1.9862 -1.9862 -1.9862 -0.8103 -0.8103 -0.8103 -0.8103 0.2514 0.2514 0.2514 0.2514 0.4748 0.4748 0.4748 0.4748 0.6921 0.6921 0.6921 0.6921 0.8703 0.8703 0.8703 0.8703 1.1648 1.1648 1.1648 1.1648 1.5731 1.5731 1.5731 1.5731 2.2200 2.2200 2.2200 2.2200 2.5418 2.5418 2.5418 2.5418 3.4178 3.4178 3.4178 3.4178 10.8637 10.8637 10.8637 10.8637 13.0260 13.0260 13.0260 13.0260 18.3725 18.3725 k = 0.5000 0.5000-0.0000 ( 2828 PWs) bands (ev): -17.6453 -17.6453 -17.6453 -17.6453 -17.3553 -17.3553 -17.3553 -17.3553 -1.9868 -1.9868 -1.9868 -1.9868 -0.8105 -0.8105 -0.8105 -0.8105 0.2538 0.2538 0.2538 0.2538 0.4762 0.4762 0.4762 0.4762 0.6904 0.6904 0.6904 0.6904 0.8716 0.8716 0.8716 0.8716 1.1629 1.1629 1.1629 1.1629 1.5747 1.5747 1.5747 1.5747 2.2167 2.2167 2.2167 2.2167 2.5420 2.5420 2.5420 2.5420 3.4179 3.4179 3.4179 3.4179 10.8664 10.8664 10.8664 10.8664 13.0227 13.0227 13.0227 13.0227 18.3757 18.3757 k = 0.5000 0.5000-0.0000 ( 2828 PWs) bands (ev): -17.6453 -17.6453 -17.6453 -17.6453 -17.3553 -17.3553 -17.3553 -17.3553 -1.9868 -1.9868 -1.9868 -1.9868 -0.8105 -0.8105 -0.8105 -0.8105 0.2538 0.2538 0.2538 0.2538 0.4762 0.4762 0.4762 0.4762 0.6904 0.6904 0.6904 0.6904 0.8716 0.8716 0.8716 0.8716 1.1629 1.1629 1.1629 1.1629 1.5747 1.5747 1.5747 1.5747 2.2167 2.2167 2.2167 2.2167 2.5420 2.5420 2.5420 2.5420 3.4179 3.4179 3.4179 3.4179 10.8664 10.8664 10.8664 10.8664 13.0227 13.0227 13.0227 13.0227 18.3757 18.3757 k = 0.4896 0.4896-0.0000 ( 2828 PWs) bands (ev): -17.6462 -17.6462 -17.6450 -17.6450 -17.3553 -17.3553 -17.3548 -17.3548 -1.9869 -1.9869 -1.9854 -1.9854 -0.8104 -0.8104 -0.8102 -0.8102 0.2491 0.2491 0.2537 0.2537 0.4695 0.4695 0.4801 0.4801 0.6900 0.6900 0.6941 0.6941 0.8688 0.8688 0.8719 0.8719 1.1628 1.1628 1.1668 1.1668 1.5706 1.5706 1.5756 1.5756 2.2165 2.2165 2.2235 2.2235 2.5417 2.5417 2.5419 2.5419 3.4176 3.4176 3.4180 3.4180 10.8596 10.8596 10.8678 10.8678 13.0233 13.0233 13.0288 13.0288 18.3686 18.3688 k = 0.4792 0.4792-0.0000 ( 2828 PWs) bands (ev): -17.6487 -17.6487 -17.6443 -17.6443 -17.3552 -17.3552 -17.3531 -17.3531 -1.9872 -1.9872 -1.9812 -1.9812 -0.8104 -0.8104 -0.8096 -0.8096 0.2360 0.2360 0.2533 0.2533 0.4507 0.4507 0.4907 0.4907 0.6889 0.6889 0.7037 0.7037 0.8611 0.8611 0.8729 0.8729 1.1623 1.1623 1.1780 1.1780 1.5588 1.5588 1.5780 1.5780 2.2158 2.2158 2.2431 2.2431 2.5407 2.5407 2.5417 2.5417 3.4167 3.4167 3.4180 3.4180 10.8393 10.8393 10.8718 10.8718 13.0248 13.0248 13.0468 13.0468 18.3475 18.3475 k = 0.4688 0.4687-0.0000 ( 2828 PWs) bands (ev): -17.6529 -17.6529 -17.6429 -17.6429 -17.3549 -17.3549 -17.3503 -17.3503 -1.9877 -1.9877 -1.9743 -1.9743 -0.8102 -0.8102 -0.8086 -0.8086 0.2165 0.2165 0.2525 0.2525 0.4227 0.4227 0.5062 0.5062 0.6867 0.6867 0.7160 0.7160 0.8503 0.8503 0.8748 0.8748 1.1616 1.1616 1.1951 1.1951 1.5410 1.5410 1.5820 1.5820 2.2146 2.2146 2.2739 2.2739 2.5392 2.5392 2.5414 2.5414 3.4152 3.4152 3.4181 3.4181 10.8062 10.8062 10.8786 10.8786 13.0275 13.0275 13.0761 13.0761 18.3133 18.3133 k = 0.4583 0.4583-0.0000 ( 2820 PWs) bands (ev): -17.6585 -17.6585 -17.6411 -17.6411 -17.3546 -17.3546 -17.3466 -17.3466 -1.9884 -1.9884 -1.9646 -1.9646 -0.8100 -0.8100 -0.8071 -0.8071 0.1924 0.1924 0.2509 0.2509 0.3886 0.3886 0.5244 0.5244 0.6831 0.6831 0.7278 0.7278 0.8392 0.8392 0.8778 0.8778 1.1607 1.1607 1.2167 1.2167 1.5192 1.5192 1.5877 1.5877 2.2130 2.2130 2.3135 2.3135 2.5371 2.5371 2.5410 2.5410 3.4133 3.4133 3.4183 3.4183 10.7614 10.7614 10.8880 10.8880 13.0312 13.0312 13.1155 13.1155 18.2672 18.2672 k = 0.4479 0.4479-0.0000 ( 2824 PWs) bands (ev): -17.6656 -17.6656 -17.6388 -17.6388 -17.3542 -17.3542 -17.3421 -17.3421 -1.9893 -1.9893 -1.9522 -1.9522 -0.8098 -0.8098 -0.8053 -0.8053 0.1651 0.1651 0.2471 0.2471 0.3514 0.3514 0.5440 0.5440 0.6775 0.6775 0.7364 0.7364 0.8305 0.8305 0.8823 0.8823 1.1594 1.1594 1.2414 1.2414 1.4954 1.4954 1.5949 1.5949 2.2109 2.2109 2.3596 2.3596 2.5345 2.5345 2.5407 2.5407 3.4106 3.4106 3.4185 3.4185 10.7061 10.7061 10.9001 10.9001 13.0358 13.0358 13.1639 13.1639 18.2107 18.2107 k = 0.4375 0.4375-0.0000 ( 2818 PWs) bands (ev): -17.6738 -17.6738 -17.6359 -17.6359 -17.3537 -17.3537 -17.3369 -17.3369 -1.9904 -1.9904 -1.9372 -1.9372 -0.8095 -0.8095 -0.8030 -0.8030 0.1356 0.1356 0.2376 0.2376 0.3158 0.3158 0.5639 0.5639 0.6690 0.6690 0.7402 0.7402 0.8264 0.8264 0.8887 0.8887 1.1579 1.1579 1.2681 1.2681 1.4712 1.4712 1.6038 1.6038 2.2084 2.2084 2.4097 2.4097 2.5314 2.5314 2.5413 2.5413 3.4075 3.4075 3.4187 3.4187 10.6415 10.6415 10.9149 10.9149 13.0415 13.0415 13.2199 13.2199 18.1453 18.1453 k = 0.4271 0.4271-0.0000 ( 2814 PWs) bands (ev): -17.6831 -17.6831 -17.6326 -17.6326 -17.3531 -17.3531 -17.3311 -17.3311 -1.9918 -1.9918 -1.9196 -1.9196 -0.8092 -0.8092 -0.8004 -0.8004 0.1044 0.1044 0.2141 0.2141 0.2908 0.2908 0.5833 0.5833 0.6573 0.6573 0.7402 0.7402 0.8266 0.8266 0.8973 0.8973 1.1560 1.1560 1.2960 1.2960 1.4479 1.4479 1.6142 1.6142 2.2055 2.2055 2.4598 2.4598 2.5282 2.5282 2.5448 2.5448 3.4041 3.4041 3.4190 3.4190 10.5690 10.5690 10.9324 10.9324 13.0482 13.0482 13.2822 13.2822 18.0725 18.0725 k = 0.4167 0.4167-0.0000 ( 2814 PWs) bands (ev): -17.6934 -17.6934 -17.6287 -17.6287 -17.3524 -17.3524 -17.3250 -17.3250 -1.9935 -1.9935 -1.8995 -1.8995 -0.8088 -0.8088 -0.7975 -0.7975 0.0716 0.0716 0.1746 0.1746 0.2797 0.2797 0.6015 0.6015 0.6423 0.6423 0.7387 0.7387 0.8289 0.8289 0.9082 0.9082 1.1539 1.1539 1.3243 1.3243 1.4265 1.4265 1.6262 1.6262 2.2021 2.2021 2.4978 2.4978 2.5256 2.5256 2.5616 2.5616 3.4002 3.4002 3.4193 3.4193 10.4897 10.4897 10.9525 10.9525 13.0557 13.0557 13.3496 13.3496 17.9940 17.9940 k = 0.4062 0.4062-0.0000 ( 2818 PWs) bands (ev): -17.7044 -17.7044 -17.6244 -17.6244 -17.3516 -17.3516 -17.3185 -17.3185 -1.9955 -1.9955 -1.8771 -1.8771 -0.8084 -0.8084 -0.7943 -0.7943 0.0370 0.0370 0.1267 0.1267 0.2757 0.2757 0.6144 0.6144 0.6284 0.6284 0.7376 0.7376 0.8316 0.8316 0.9209 0.9209 1.1515 1.1515 1.3515 1.3515 1.4086 1.4086 1.6397 1.6397 2.1983 2.1983 2.5083 2.5083 2.5247 2.5247 2.6049 2.6049 3.3959 3.3959 3.4196 3.4196 10.4046 10.4046 10.9752 10.9752 13.0642 13.0642 13.4210 13.4210 17.9110 17.9110 k = 0.3958 0.3958-0.0000 ( 2810 PWs) bands (ev): -17.7162 -17.7162 -17.6196 -17.6196 -17.3508 -17.3508 -17.3119 -17.3119 -1.9977 -1.9977 -1.8523 -1.8523 -0.8078 -0.8078 -0.7909 -0.7909 0.0002 0.0002 0.0765 0.0765 0.2744 0.2744 0.6011 0.6011 0.6372 0.6372 0.7378 0.7378 0.8340 0.8340 0.9350 0.9350 1.1488 1.1488 1.3699 1.3699 1.4020 1.4020 1.6546 1.6546 2.1941 2.1941 2.5063 2.5063 2.5241 2.5241 2.6610 2.6610 3.3913 3.3913 3.4201 3.4201 10.3147 10.3147 11.0005 11.0005 13.0735 13.0735 13.4954 13.4954 17.8248 17.8248 k = 0.3854 0.3854-0.0000 ( 2806 PWs) bands (ev): -17.7284 -17.7284 -17.6144 -17.6144 -17.3498 -17.3498 -17.3052 -17.3052 -2.0004 -2.0004 -1.8255 -1.8255 -0.8072 -0.8072 -0.7874 -0.7874 -0.0405 -0.0405 0.0273 0.0273 0.2744 0.2744 0.5804 0.5804 0.6504 0.6504 0.7394 0.7394 0.8359 0.8359 0.9496 0.9496 1.1458 1.1458 1.3653 1.3653 1.4207 1.4207 1.6709 1.6709 2.1896 2.1896 2.5012 2.5012 2.5228 2.5228 2.7204 2.7204 3.3864 3.3864 3.4205 3.4205 10.2208 10.2208 11.0284 11.0284 13.0836 13.0836 13.5718 13.5718 17.7365 17.7365 k = 0.3750 0.3750-0.0000 ( 2806 PWs) bands (ev): -17.7412 -17.7412 -17.6087 -17.6087 -17.3488 -17.3488 -17.2985 -17.2985 -2.0034 -2.0034 -1.7967 -1.7967 -0.8067 -0.8067 -0.7837 -0.7837 -0.0866 -0.0866 -0.0178 -0.0178 0.2750 0.2750 0.5589 0.5589 0.6619 0.6619 0.7423 0.7423 0.8373 0.8373 0.9644 0.9644 1.1426 1.1426 1.3549 1.3549 1.4475 1.4475 1.6885 1.6885 2.1847 2.1847 2.4950 2.4950 2.5211 2.5211 2.7806 2.7806 3.3815 3.3815 3.4210 3.4210 10.1235 10.1235 11.0588 11.0588 13.0945 13.0945 13.6495 13.6495 17.6470 17.6470 k = 0.3646 0.3646-0.0000 ( 2806 PWs) bands (ev): -17.7543 -17.7543 -17.6026 -17.6026 -17.3478 -17.3478 -17.2918 -17.2918 -2.0069 -2.0069 -1.7662 -1.7662 -0.8062 -0.8062 -0.7798 -0.7798 -0.1379 -0.1379 -0.0581 -0.0581 0.2761 0.2761 0.5375 0.5375 0.6713 0.6713 0.7466 0.7466 0.8383 0.8383 0.9788 0.9788 1.1391 1.1391 1.3458 1.3458 1.4751 1.4751 1.7073 1.7073 2.1794 2.1794 2.4881 2.4881 2.5191 2.5191 2.8408 2.8408 3.3765 3.3765 3.4216 3.4216 10.0235 10.0235 11.0917 11.0917 13.1060 13.1060 13.7277 13.7277 17.5572 17.5572 k = 0.3542 0.3542-0.0000 ( 2802 PWs) bands (ev): -17.7676 -17.7676 -17.5961 -17.5961 -17.3467 -17.3467 -17.2853 -17.2853 -2.0108 -2.0108 -1.7341 -1.7341 -0.8056 -0.8056 -0.7759 -0.7759 -0.1923 -0.1923 -0.0949 -0.0949 0.2775 0.2775 0.5166 0.5166 0.6787 0.6787 0.7520 0.7520 0.8391 0.8391 0.9926 0.9926 1.1354 1.1354 1.3390 1.3390 1.5024 1.5024 1.7272 1.7272 2.1739 2.1739 2.4807 2.4807 2.5169 2.5169 2.9002 2.9002 3.3715 3.3715 3.4222 3.4222 9.9213 9.9213 11.1271 11.1271 13.1182 13.1182 13.8058 13.8058 17.4681 17.4681 k = 0.3438 0.3437-0.0000 ( 2796 PWs) bands (ev): -17.7812 -17.7812 -17.5891 -17.5891 -17.3455 -17.3455 -17.2790 -17.2790 -2.0153 -2.0153 -1.7009 -1.7009 -0.8049 -0.8049 -0.7720 -0.7720 -0.2479 -0.2479 -0.1294 -0.1294 0.2792 0.2792 0.4965 0.4965 0.6842 0.6842 0.7580 0.7580 0.8397 0.8397 1.0054 1.0054 1.1316 1.1316 1.3346 1.3346 1.5290 1.5290 1.7481 1.7481 2.1681 2.1681 2.4729 2.4729 2.5147 2.5147 2.9587 2.9587 3.3667 3.3667 3.4229 3.4229 9.8173 9.8173 11.1650 11.1650 13.1310 13.1310 13.8829 13.8829 17.3803 17.3803 k = 0.3333 0.3333-0.0000 ( 2798 PWs) bands (ev): -17.7950 -17.7950 -17.5819 -17.5819 -17.3443 -17.3443 -17.2729 -17.2729 -2.0204 -2.0204 -1.6670 -1.6670 -0.8043 -0.8043 -0.7682 -0.7682 -0.3029 -0.3029 -0.1626 -0.1626 0.2811 0.2811 0.4775 0.4775 0.6883 0.6883 0.7643 0.7643 0.8402 0.8402 1.0169 1.0169 1.1275 1.1275 1.3327 1.3327 1.5546 1.5546 1.7697 1.7697 2.1622 2.1622 2.4647 2.4647 2.5125 2.5125 3.0157 3.0157 3.3621 3.3621 3.4236 3.4236 9.7120 9.7120 11.2052 11.2052 13.1443 13.1443 13.9585 13.9585 17.2946 17.2946 k = 0.3229 0.3229-0.0000 ( 2798 PWs) bands (ev): -17.8088 -17.8088 -17.5742 -17.5742 -17.3430 -17.3430 -17.2671 -17.2671 -2.0261 -2.0261 -1.6326 -1.6326 -0.8036 -0.8036 -0.7645 -0.7645 -0.3562 -0.3562 -0.1947 -0.1947 0.2831 0.2831 0.4597 0.4597 0.6914 0.6914 0.7704 0.7704 0.8405 0.8405 1.0272 1.0272 1.1233 1.1233 1.3332 1.3332 1.5791 1.5791 1.7920 1.7920 2.1560 2.1560 2.4562 2.4562 2.5104 2.5104 3.0713 3.0713 3.3578 3.3578 3.4245 3.4245 9.6056 9.6056 11.2477 11.2477 13.1580 13.1580 14.0319 14.0319 17.2117 17.2117 k = 0.3125 0.3125-0.0000 ( 2806 PWs) bands (ev): -17.8227 -17.8227 -17.5663 -17.5663 -17.3417 -17.3417 -17.2615 -17.2615 -2.0326 -2.0326 -1.5985 -1.5985 -0.8029 -0.8029 -0.7609 -0.7609 -0.4067 -0.4067 -0.2260 -0.2260 0.2852 0.2852 0.4433 0.4433 0.6937 0.6937 0.7761 0.7761 0.8407 0.8407 1.0359 1.0359 1.1191 1.1191 1.3359 1.3359 1.6023 1.6023 1.8148 1.8148 2.1499 2.1499 2.4475 2.4475 2.5083 2.5083 3.1249 3.1249 3.3538 3.3538 3.4254 3.4254 9.4986 9.4986 11.2925 11.2925 13.1721 13.1721 14.1024 14.1024 17.1325 17.1325 k = 0.3021 0.3021-0.0000 ( 2802 PWs) bands (ev): -17.8365 -17.8365 -17.5580 -17.5580 -17.3403 -17.3403 -17.2563 -17.2563 -2.0399 -2.0399 -1.5651 -1.5651 -0.8022 -0.8022 -0.7575 -0.7575 -0.4534 -0.4534 -0.2564 -0.2564 0.2876 0.2876 0.4285 0.4285 0.6955 0.6955 0.7813 0.7813 0.8410 0.8410 1.0431 1.0431 1.1149 1.1149 1.3405 1.3405 1.6242 1.6242 1.8379 1.8379 2.1437 2.1437 2.4385 2.4385 2.5065 2.5065 3.1767 3.1767 3.3504 3.3504 3.4265 3.4265 9.3911 9.3911 11.3396 11.3396 13.1866 13.1866 14.1692 14.1692 17.0576 17.0576 k = 0.2917 0.2917-0.0000 ( 2812 PWs) bands (ev): -17.8503 -17.8503 -17.5494 -17.5494 -17.3389 -17.3389 -17.2514 -17.2514 -2.0479 -2.0479 -1.5334 -1.5334 -0.8016 -0.8016 -0.7546 -0.7546 -0.4952 -0.4952 -0.2860 -0.2860 0.2899 0.2899 0.4151 0.4151 0.6969 0.6969 0.7856 0.7856 0.8411 0.8411 1.0486 1.0486 1.1106 1.1106 1.3468 1.3468 1.6446 1.6446 1.8612 1.8612 2.1376 2.1376 2.4294 2.4294 2.5050 2.5050 3.2261 3.2261 3.3475 3.3475 3.4278 3.4278 9.2836 9.2836 11.3887 11.3887 13.2013 13.2013 14.2315 14.2315 16.9879 16.9879 k = 0.2812 0.2812-0.0000 ( 2812 PWs) bands (ev): -17.8640 -17.8640 -17.5406 -17.5406 -17.3375 -17.3375 -17.2469 -17.2469 -2.0569 -2.0569 -1.5041 -1.5041 -0.8008 -0.8008 -0.7518 -0.7518 -0.5310 -0.5310 -0.3149 -0.3149 0.2925 0.2925 0.4037 0.4037 0.6980 0.6980 0.7893 0.7893 0.8413 0.8413 1.0525 1.0525 1.1066 1.1066 1.3543 1.3543 1.6636 1.6636 1.8845 1.8845 2.1318 2.1318 2.4201 2.4201 2.5037 2.5037 3.2729 3.2729 3.3455 3.3455 3.4295 3.4295 9.1763 9.1763 11.4400 11.4400 13.2161 13.2161 14.2886 14.2886 16.9241 16.9241 k = 0.2708 0.2708-0.0000 ( 2812 PWs) bands (ev): -17.8775 -17.8775 -17.5315 -17.5315 -17.3361 -17.3361 -17.2428 -17.2428 -2.0670 -2.0670 -1.4783 -1.4783 -0.8001 -0.8001 -0.7493 -0.7493 -0.5597 -0.5597 -0.3429 -0.3429 0.2952 0.2952 0.3940 0.3940 0.6989 0.6989 0.7921 0.7921 0.8415 0.8415 1.0546 1.0546 1.1030 1.1030 1.3628 1.3628 1.6811 1.6811 1.9076 1.9076 2.1264 2.1264 2.4108 2.4108 2.5029 2.5029 3.3156 3.3156 3.3452 3.3452 3.4320 3.4320 9.0695 9.0695 11.4933 11.4933 13.2311 13.2311 14.3396 14.3396 16.8672 16.8672 k = 0.2604 0.2604-0.0000 ( 2812 PWs) bands (ev): -17.8908 -17.8908 -17.5222 -17.5222 -17.3346 -17.3346 -17.2390 -17.2390 -2.0781 -2.0781 -1.4568 -1.4568 -0.7994 -0.7994 -0.7473 -0.7473 -0.5802 -0.5802 -0.3701 -0.3701 0.2980 0.2980 0.3861 0.3861 0.6996 0.6996 0.7942 0.7942 0.8415 0.8415 1.0548 1.0548 1.0999 1.0999 1.3717 1.3717 1.6970 1.6970 1.9304 1.9304 2.1214 2.1214 2.4014 2.4014 2.5025 2.5025 3.3384 3.3384 3.3614 3.3614 3.4364 3.4364 8.9634 8.9634 11.5486 11.5486 13.2461 13.2461 14.3836 14.3836 16.8178 16.8178 k = 0.2500 0.2500-0.0000 ( 2808 PWs) bands (ev): -17.9039 -17.9039 -17.5128 -17.5128 -17.3331 -17.3331 -17.2356 -17.2356 -2.0903 -2.0903 -1.4404 -1.4404 -0.7987 -0.7987 -0.7457 -0.7457 -0.5917 -0.5917 -0.3961 -0.3961 0.3010 0.3010 0.3801 0.3801 0.7002 0.7002 0.7957 0.7957 0.8416 0.8416 1.0531 1.0531 1.0976 1.0976 1.3808 1.3808 1.7113 1.7113 1.9527 1.9527 2.1171 2.1171 2.3921 2.3921 2.5026 2.5026 3.3401 3.3401 3.3920 3.3920 3.4461 3.4461 8.8582 8.8582 11.6057 11.6057 13.2611 13.2611 14.4198 14.4198 16.7767 16.7767 k = 0.2396 0.2396-0.0000 ( 2804 PWs) bands (ev): -17.9167 -17.9167 -17.5031 -17.5031 -17.3317 -17.3317 -17.2327 -17.2327 -2.1036 -2.1036 -1.4297 -1.4297 -0.7980 -0.7980 -0.7446 -0.7446 -0.5937 -0.5937 -0.4210 -0.4210 0.3042 0.3042 0.3760 0.3760 0.7006 0.7006 0.7964 0.7964 0.8416 0.8416 1.0496 1.0496 1.0960 1.0960 1.3895 1.3895 1.7240 1.7240 1.9743 1.9743 2.1136 2.1136 2.3828 2.3828 2.5032 2.5032 3.3409 3.3409 3.4108 3.4108 3.4669 3.4669 8.7543 8.7543 11.6646 11.6646 13.2760 13.2760 14.4476 14.4476 16.7447 16.7447 k = 0.2292 0.2292-0.0000 ( 2808 PWs) bands (ev): -17.9292 -17.9292 -17.4933 -17.4933 -17.3302 -17.3302 -17.2302 -17.2302 -2.1182 -2.1182 -1.4247 -1.4247 -0.7974 -0.7974 -0.7441 -0.7441 -0.5866 -0.5866 -0.4443 -0.4443 0.3076 0.3076 0.3735 0.3735 0.7008 0.7008 0.7965 0.7965 0.8415 0.8415 1.0444 1.0444 1.0948 1.0948 1.3975 1.3975 1.7351 1.7351 1.9950 1.9950 2.1110 2.1110 2.3736 2.3736 2.5045 2.5045 3.3421 3.3421 3.4188 3.4188 3.4964 3.4964 8.6518 8.6518 11.7252 11.7252 13.2907 13.2907 14.4664 14.4664 16.7220 16.7220 k = 0.2188 0.2187-0.0000 ( 2808 PWs) bands (ev): -17.9414 -17.9414 -17.4834 -17.4834 -17.3288 -17.3288 -17.2281 -17.2281 -2.1339 -2.1339 -1.4249 -1.4249 -0.7968 -0.7968 -0.7440 -0.7440 -0.5718 -0.5718 -0.4649 -0.4649 0.3113 0.3113 0.3725 0.3725 0.7010 0.7010 0.7961 0.7961 0.8414 0.8414 1.0379 1.0379 1.0940 1.0940 1.4045 1.4045 1.7446 1.7446 2.0148 2.0148 2.1096 2.1096 2.3645 2.3645 2.5065 2.5065 3.3440 3.3440 3.4228 3.4228 3.5279 3.5279 8.5511 8.5511 11.7874 11.7874 13.3052 13.3052 14.4758 14.4758 16.7090 16.7090 k = 0.2083 0.2083-0.0000 ( 2806 PWs) bands (ev): -17.9532 -17.9532 -17.4735 -17.4735 -17.3274 -17.3274 -17.2264 -17.2264 -2.1507 -2.1507 -1.4295 -1.4295 -0.7964 -0.7964 -0.7442 -0.7442 -0.5541 -0.5541 -0.4789 -0.4789 0.3154 0.3154 0.3731 0.3731 0.7010 0.7010 0.7952 0.7952 0.8411 0.8411 1.0303 1.0303 1.0932 1.0932 1.4101 1.4101 1.7526 1.7526 2.0334 2.0334 2.1095 2.1095 2.3556 2.3556 2.5091 2.5091 3.3464 3.3464 3.4252 3.4252 3.5586 3.5586 8.4525 8.4525 11.8512 11.8512 13.3195 13.3195 14.4758 14.4758 16.7056 16.7056 k = 0.1979 0.1979-0.0000 ( 2798 PWs) bands (ev): -17.9646 -17.9646 -17.4634 -17.4634 -17.3260 -17.3260 -17.2252 -17.2252 -2.1685 -2.1685 -1.4375 -1.4375 -0.7961 -0.7961 -0.7447 -0.7447 -0.5462 -0.5462 -0.4747 -0.4747 0.3200 0.3200 0.3752 0.3752 0.7009 0.7009 0.7938 0.7938 0.8408 0.8408 1.0218 1.0218 1.0923 1.0923 1.4141 1.4141 1.7593 1.7593 2.0508 2.0508 2.1109 2.1109 2.3469 2.3469 2.5126 2.5126 3.3496 3.3496 3.4271 3.4271 3.5877 3.5877 8.3560 8.3560 11.9164 11.9164 13.3334 13.3334 14.4666 14.4666 16.7116 16.7116 k = 0.1875 0.1875-0.0000 ( 2802 PWs) bands (ev): -17.9756 -17.9756 -17.4534 -17.4534 -17.3246 -17.3246 -17.2243 -17.2243 -2.1873 -2.1873 -1.4479 -1.4479 -0.7958 -0.7958 -0.7457 -0.7457 -0.5553 -0.5553 -0.4464 -0.4464 0.3250 0.3250 0.3785 0.3785 0.7006 0.7006 0.7921 0.7921 0.8402 0.8402 1.0125 1.0125 1.0910 1.0910 1.4164 1.4164 1.7644 1.7644 2.0668 2.0668 2.1137 2.1137 2.3385 2.3385 2.5167 2.5167 3.3531 3.3531 3.4286 3.4286 3.6149 3.6149 8.2622 8.2622 11.9830 11.9830 13.3469 13.3469 14.4485 14.4485 16.7262 16.7262 k = 0.1771 0.1771-0.0000 ( 2798 PWs) bands (ev): -17.9862 -17.9862 -17.4433 -17.4433 -17.3233 -17.3233 -17.2240 -17.2240 -2.2068 -2.2068 -1.4597 -1.4597 -0.7957 -0.7957 -0.7469 -0.7469 -0.5710 -0.5710 -0.4055 -0.4055 0.3305 0.3305 0.3830 0.3830 0.7002 0.7002 0.7901 0.7901 0.8395 0.8395 1.0024 1.0024 1.0893 1.0893 1.4169 1.4169 1.7682 1.7682 2.0815 2.0815 2.1182 2.1182 2.3304 2.3304 2.5216 2.5216 3.3572 3.3572 3.4300 3.4300 3.6401 3.6401 8.1711 8.1711 12.0508 12.0508 13.3599 13.3599 14.4222 14.4222 16.7488 16.7488 k = 0.1667 0.1667-0.0000 ( 2794 PWs) bands (ev): -17.9963 -17.9963 -17.4332 -17.4332 -17.3220 -17.3220 -17.2240 -17.2240 -2.2269 -2.2269 -1.4722 -1.4722 -0.7957 -0.7957 -0.7483 -0.7483 -0.5881 -0.5881 -0.3582 -0.3582 0.3362 0.3362 0.3888 0.3888 0.6997 0.6997 0.7878 0.7878 0.8387 0.8387 0.9917 0.9917 1.0870 1.0870 1.4154 1.4154 1.7709 1.7709 2.0948 2.0948 2.1242 2.1242 2.3226 2.3226 2.5271 2.5271 3.3616 3.3616 3.4314 3.4314 3.6633 3.6633 8.0832 8.0832 12.1198 12.1198 13.3724 13.3724 14.3884 14.3884 16.7783 16.7783 k = 0.1562 0.1562-0.0000 ( 2792 PWs) bands (ev): -18.0059 -18.0059 -17.4232 -17.4232 -17.3207 -17.3207 -17.2245 -17.2245 -2.2473 -2.2473 -1.4848 -1.4848 -0.7958 -0.7958 -0.7499 -0.7499 -0.6051 -0.6051 -0.3068 -0.3068 0.3422 0.3422 0.3957 0.3957 0.6990 0.6990 0.7853 0.7853 0.8374 0.8374 0.9805 0.9805 1.0840 1.0840 1.4121 1.4121 1.7725 1.7725 2.1068 2.1068 2.1316 2.1316 2.3151 2.3151 2.5332 2.5332 3.3663 3.3663 3.4328 3.4328 3.6845 3.6845 7.9986 7.9986 12.1899 12.1899 13.3844 13.3844 14.3481 14.3481 16.8136 16.8136 k = 0.1458 0.1458-0.0000 ( 2796 PWs) bands (ev): -18.0149 -18.0149 -17.4133 -17.4133 -17.3195 -17.3195 -17.2253 -17.2253 -2.2679 -2.2679 -1.4971 -1.4971 -0.7960 -0.7960 -0.7516 -0.7516 -0.6215 -0.6215 -0.2526 -0.2526 0.3481 0.3481 0.4039 0.4039 0.6981 0.6981 0.7827 0.7827 0.8358 0.8358 0.9687 0.9687 1.0802 1.0802 1.4072 1.4072 1.7730 1.7730 2.1176 2.1176 2.1401 2.1401 2.3080 2.3080 2.5399 2.5399 3.3710 3.3710 3.4342 3.4342 3.7037 3.7037 7.9178 7.9178 12.2609 12.2609 13.3958 13.3958 14.3019 14.3019 16.8538 16.8538 k = 0.1354 0.1354-0.0000 ( 2792 PWs) bands (ev): -18.0235 -18.0235 -17.4035 -17.4035 -17.3184 -17.3184 -17.2266 -17.2266 -2.2884 -2.2884 -1.5088 -1.5088 -0.7964 -0.7964 -0.7533 -0.7533 -0.6369 -0.6369 -0.1966 -0.1966 0.3540 0.3540 0.4133 0.4133 0.6969 0.6969 0.7800 0.7800 0.8337 0.8337 0.9565 0.9565 1.0755 1.0755 1.4009 1.4009 1.7728 1.7728 2.1273 2.1273 2.1495 2.1495 2.3015 2.3015 2.5469 2.5469 3.3758 3.3758 3.4356 3.4356 3.7210 3.7210 7.8408 7.8408 12.3328 12.3328 13.4065 13.4065 14.2507 14.2507 16.8976 16.8976 k = 0.1250 0.1250-0.0000 ( 2792 PWs) bands (ev): -18.0315 -18.0315 -17.3938 -17.3938 -17.3173 -17.3173 -17.2283 -17.2283 -2.3084 -2.3084 -1.5196 -1.5196 -0.7969 -0.7969 -0.7550 -0.7550 -0.6514 -0.6514 -0.1394 -0.1394 0.3596 0.3596 0.4238 0.4238 0.6956 0.6956 0.7771 0.7771 0.8309 0.8309 0.9441 0.9441 1.0696 1.0696 1.3935 1.3935 1.7719 1.7719 2.1357 2.1357 2.1597 2.1597 2.2953 2.2953 2.5542 2.5542 3.3806 3.3806 3.4371 3.4371 3.7364 3.7364 7.7682 7.7682 12.4054 12.4054 13.4166 13.4166 14.1953 14.1953 16.9440 16.9440 k = 0.1146 0.1146-0.0000 ( 2794 PWs) bands (ev): -18.0389 -18.0389 -17.3843 -17.3843 -17.3163 -17.3163 -17.2304 -17.2304 -2.3279 -2.3279 -1.5296 -1.5296 -0.7976 -0.7976 -0.7566 -0.7566 -0.6649 -0.6649 -0.0816 -0.0816 0.3649 0.3649 0.4354 0.4354 0.6940 0.6940 0.7741 0.7741 0.8273 0.8273 0.9317 0.9317 1.0627 1.0627 1.3852 1.3852 1.7705 1.7705 2.1431 2.1431 2.1704 2.1704 2.2897 2.2897 2.5616 2.5616 3.3852 3.3852 3.4387 3.4387 3.7502 3.7502 7.7000 7.7000 12.4786 12.4786 13.4259 13.4259 14.1364 14.1364 16.9920 16.9920 k = 0.1042 0.1042-0.0000 ( 2786 PWs) bands (ev): -18.0457 -18.0457 -17.3750 -17.3750 -17.3154 -17.3154 -17.2329 -17.2329 -2.3465 -2.3465 -1.5386 -1.5386 -0.7984 -0.7984 -0.7580 -0.7580 -0.6771 -0.6771 -0.0236 -0.0236 0.3699 0.3699 0.4478 0.4478 0.6921 0.6921 0.7711 0.7711 0.8225 0.8225 0.9196 0.9196 1.0546 1.0546 1.3766 1.3766 1.7687 1.7687 2.1495 2.1495 2.1813 2.1813 2.2847 2.2847 2.5689 2.5689 3.3895 3.3895 3.4405 3.4405 3.7623 3.7623 7.6367 7.6367 12.5524 12.5524 13.4345 13.4345 14.0745 14.0745 17.0405 17.0405 k = 0.0938 0.0937-0.0000 ( 2786 PWs) bands (ev): -18.0519 -18.0519 -17.3659 -17.3659 -17.3145 -17.3145 -17.2357 -17.2357 -2.3640 -2.3640 -1.5466 -1.5466 -0.7994 -0.7994 -0.7594 -0.7594 -0.6883 -0.6883 0.0339 0.0339 0.3746 0.3746 0.4607 0.4607 0.6899 0.6899 0.7679 0.7679 0.8163 0.8163 0.9080 0.9080 1.0455 1.0455 1.3679 1.3679 1.7667 1.7667 2.1548 2.1548 2.1921 2.1921 2.2803 2.2803 2.5761 2.5761 3.3934 3.3934 3.4423 3.4423 3.7728 3.7728 7.5785 7.5785 12.6265 12.6265 13.4423 13.4423 14.0103 14.0103 17.0884 17.0884 k = 0.0833 0.0833-0.0000 ( 2790 PWs) bands (ev): -18.0575 -18.0575 -17.3572 -17.3572 -17.3138 -17.3138 -17.2389 -17.2389 -2.3802 -2.3802 -1.5537 -1.5537 -0.8004 -0.8004 -0.7606 -0.7606 -0.6984 -0.6984 0.0904 0.0904 0.3788 0.3788 0.4741 0.4741 0.6873 0.6873 0.7643 0.7643 0.8085 0.8085 0.8973 0.8973 1.0355 1.0355 1.3593 1.3593 1.7645 1.7645 2.1592 2.1592 2.2024 2.2024 2.2766 2.2766 2.5829 2.5829 3.3970 3.3970 3.4442 3.4442 3.7819 3.7819 7.5256 7.5256 12.7007 12.7007 13.4492 13.4492 13.9443 13.9443 17.1348 17.1348 k = 0.0729 0.0729-0.0000 ( 2793 PWs) bands (ev): -18.0625 -18.0625 -17.3487 -17.3487 -17.3131 -17.3131 -17.2424 -17.2424 -2.3949 -2.3949 -1.5599 -1.5599 -0.8015 -0.8015 -0.7616 -0.7616 -0.7073 -0.7073 0.1454 0.1454 0.3826 0.3826 0.4877 0.4877 0.6844 0.6844 0.7601 0.7601 0.7991 0.7991 0.8879 0.8879 1.0248 1.0248 1.3515 1.3515 1.7623 1.7623 2.1628 2.1628 2.2118 2.2118 2.2738 2.2738 2.5892 2.5892 3.4000 3.4000 3.4461 3.4461 3.7896 3.7896 7.4783 7.4783 12.7749 12.7749 13.4553 13.4553 13.8770 13.8770 17.1788 17.1788 k = 0.0625 0.0625-0.0000 ( 2781 PWs) bands (ev): -18.0668 -18.0668 -17.3407 -17.3407 -17.3124 -17.3124 -17.2460 -17.2460 -2.4080 -2.4080 -1.5651 -1.5651 -0.8025 -0.8025 -0.7624 -0.7624 -0.7150 -0.7150 0.1983 0.1983 0.3861 0.3861 0.5011 0.5011 0.6809 0.6809 0.7544 0.7544 0.7893 0.7893 0.8800 0.8800 1.0141 1.0141 1.3444 1.3444 1.7602 1.7602 2.1659 2.1659 2.2199 2.2199 2.2720 2.2720 2.5950 2.5950 3.4027 3.4027 3.4481 3.4481 3.7961 3.7961 7.4368 7.4368 12.8487 12.8487 13.4603 13.4603 13.8090 13.8090 17.2193 17.2193 k = 0.0521 0.0521-0.0000 ( 2777 PWs) bands (ev): -18.0705 -18.0705 -17.3332 -17.3332 -17.3119 -17.3119 -17.2499 -17.2499 -2.4193 -2.4193 -1.5694 -1.5694 -0.8035 -0.8035 -0.7631 -0.7631 -0.7215 -0.7215 0.2482 0.2482 0.3892 0.3892 0.5141 0.5141 0.6766 0.6766 0.7458 0.7458 0.7806 0.7806 0.8734 0.8734 1.0038 1.0038 1.3383 1.3383 1.7582 1.7582 2.1683 2.1683 2.2265 2.2265 2.2713 2.2713 2.6000 2.6000 3.4048 3.4048 3.4499 3.4499 3.8013 3.8013 7.4013 7.4013 12.9216 12.9216 13.4642 13.4642 13.7411 13.7411 17.2554 17.2554 k = 0.0417 0.0417-0.0000 ( 2775 PWs) bands (ev): -18.0735 -18.0735 -17.3263 -17.3263 -17.3114 -17.3114 -17.2537 -17.2537 -2.4288 -2.4288 -1.5729 -1.5729 -0.8045 -0.8045 -0.7636 -0.7636 -0.7267 -0.7267 0.2940 0.2940 0.3919 0.3919 0.5265 0.5265 0.6710 0.6710 0.7341 0.7341 0.7744 0.7744 0.8681 0.8681 0.9944 0.9944 1.3332 1.3332 1.7565 1.7565 2.1702 2.1702 2.2312 2.2312 2.2717 2.2717 2.6043 2.6043 3.4064 3.4064 3.4514 3.4514 3.8056 3.8056 7.3720 7.3720 12.9929 12.9929 13.4666 13.4666 13.6746 13.6746 17.2861 17.2861 k = 0.0312 0.0312-0.0000 ( 2777 PWs) bands (ev): -18.0758 -18.0758 -17.3203 -17.3203 -17.3110 -17.3110 -17.2574 -17.2574 -2.4362 -2.4362 -1.5756 -1.5756 -0.8052 -0.8052 -0.7640 -0.7640 -0.7308 -0.7308 0.3339 0.3339 0.3944 0.3944 0.5379 0.5379 0.6634 0.6634 0.7215 0.7215 0.7706 0.7706 0.8638 0.8638 0.9866 0.9866 1.3292 1.3292 1.7551 1.7551 2.1717 2.1717 2.2342 2.2342 2.2728 2.2728 2.6077 2.6077 3.4077 3.4077 3.4528 3.4528 3.8087 3.8087 7.3491 7.3491 13.0611 13.0611 13.4665 13.4665 13.6119 13.6119 17.3104 17.3104 k = 0.0208 0.0208-0.0000 ( 2775 PWs) bands (ev): -18.0775 -18.0775 -17.3157 -17.3157 -17.3105 -17.3105 -17.2606 -17.2606 -2.4416 -2.4416 -1.5775 -1.5775 -0.8058 -0.8058 -0.7643 -0.7643 -0.7337 -0.7337 0.3651 0.3651 0.3973 0.3973 0.5479 0.5479 0.6539 0.6539 0.7110 0.7110 0.7683 0.7683 0.8608 0.8608 0.9807 0.9807 1.3263 1.3263 1.7541 1.7541 2.1726 2.1726 2.2359 2.2359 2.2742 2.2742 2.6102 2.6102 3.4086 3.4086 3.4538 3.4538 3.8109 3.8109 7.3326 7.3326 13.1230 13.1230 13.4617 13.4617 13.5587 13.5587 17.3240 17.3240 k = 0.0104 0.0104-0.0000 ( 2775 PWs) bands (ev): -18.0785 -18.0785 -17.3131 -17.3131 -17.3097 -17.3097 -17.2629 -17.2629 -2.4448 -2.4448 -1.5786 -1.5786 -0.8062 -0.8062 -0.7645 -0.7645 -0.7355 -0.7355 0.3827 0.3827 0.4022 0.4022 0.5555 0.5555 0.6445 0.6445 0.7046 0.7046 0.7671 0.7671 0.8588 0.8588 0.9770 0.9770 1.3246 1.3246 1.7535 1.7535 2.1732 2.1732 2.2367 2.2367 2.2752 2.2752 2.6117 2.6117 3.4091 3.4091 3.4544 3.4544 3.8122 3.8122 7.3227 7.3227 13.1712 13.1712 13.4490 13.4490 13.5255 13.5255 17.3218 17.3218 k = 0.0000 0.0000 0.0000 ( 2777 PWs) bands (ev): -18.0789 -18.0789 -17.3124 -17.3124 -17.3092 -17.3092 -17.2637 -17.2637 -2.4459 -2.4459 -1.5790 -1.5790 -0.8063 -0.8063 -0.7646 -0.7646 -0.7360 -0.7360 0.3870 0.3870 0.4059 0.4059 0.5586 0.5586 0.6403 0.6403 0.7026 0.7026 0.7666 0.7666 0.8582 0.8582 0.9758 0.9758 1.3239 1.3239 1.7533 1.7533 2.1734 2.1734 2.2369 2.2369 2.2756 2.2756 2.6122 2.6122 3.4092 3.4092 3.4546 3.4546 3.8127 3.8127 7.3193 7.3193 13.1909 13.1909 13.4396 13.4396 13.5160 13.5160 17.3201 17.3201 k = 0.0000 0.0000 0.0000 ( 2777 PWs) bands (ev): -18.0789 -18.0789 -17.3124 -17.3124 -17.3092 -17.3092 -17.2637 -17.2637 -2.4459 -2.4459 -1.5790 -1.5790 -0.8063 -0.8063 -0.7646 -0.7646 -0.7360 -0.7360 0.3870 0.3870 0.4059 0.4059 0.5586 0.5586 0.6403 0.6403 0.7026 0.7026 0.7666 0.7666 0.8582 0.8582 0.9758 0.9758 1.3239 1.3239 1.7533 1.7533 2.1734 2.1734 2.2369 2.2369 2.2756 2.2756 2.6122 2.6122 3.4092 3.4092 3.4546 3.4546 3.8127 3.8127 7.3193 7.3193 13.1909 13.1909 13.4396 13.4396 13.5160 13.5160 17.3201 17.3201 k = 0.0000 0.0000 0.0147 ( 2773 PWs) bands (ev): -18.0785 -18.0785 -17.3123 -17.3123 -17.3091 -17.3091 -17.2637 -17.2637 -2.4451 -2.4451 -1.5786 -1.5786 -0.8065 -0.8065 -0.7648 -0.7648 -0.7355 -0.7355 0.3878 0.3878 0.4068 0.4068 0.5542 0.5542 0.6403 0.6403 0.7021 0.7021 0.7672 0.7672 0.8576 0.8576 0.9757 0.9757 1.3267 1.3267 1.7512 1.7512 2.1733 2.1733 2.2372 2.2372 2.2758 2.2758 2.6117 2.6117 3.4080 3.4080 3.4533 3.4533 3.8119 3.8119 7.3229 7.3229 13.1915 13.1915 13.4423 13.4423 13.5187 13.5187 17.3204 17.3204 k = 0.0000 0.0000 0.0294 ( 2781 PWs) bands (ev): -18.0776 -18.0776 -17.3122 -17.3122 -17.3090 -17.3090 -17.2638 -17.2638 -2.4428 -2.4428 -1.5778 -1.5778 -0.8072 -0.8072 -0.7657 -0.7657 -0.7341 -0.7341 0.3901 0.3901 0.4095 0.4095 0.5414 0.5414 0.6401 0.6401 0.7004 0.7004 0.7688 0.7688 0.8557 0.8557 0.9751 0.9751 1.3349 1.3349 1.7449 1.7449 2.1728 2.1728 2.2378 2.2378 2.2763 2.2763 2.6103 2.6103 3.4041 3.4041 3.4494 3.4494 3.8098 3.8098 7.3337 7.3337 13.1933 13.1933 13.4506 13.4506 13.5270 13.5270 17.3214 17.3215 k = 0.0000 0.0000 0.0442 ( 2781 PWs) bands (ev): -18.0760 -18.0760 -17.3120 -17.3120 -17.3088 -17.3088 -17.2640 -17.2640 -2.4389 -2.4389 -1.5762 -1.5762 -0.8083 -0.8083 -0.7672 -0.7672 -0.7316 -0.7316 0.3938 0.3938 0.4139 0.4139 0.5214 0.5214 0.6394 0.6394 0.6978 0.6978 0.7709 0.7709 0.8527 0.8527 0.9742 0.9742 1.3481 1.3481 1.7346 1.7346 2.1721 2.1721 2.2389 2.2389 2.2771 2.2771 2.6081 2.6081 3.3978 3.3978 3.4431 3.4431 3.8062 3.8062 7.3515 7.3515 13.1962 13.1962 13.4642 13.4642 13.5407 13.5407 17.3230 17.3230 k = 0.0000 0.0000 0.0589 ( 2789 PWs) bands (ev): -18.0737 -18.0737 -17.3117 -17.3117 -17.3085 -17.3085 -17.2643 -17.2643 -2.4334 -2.4334 -1.5740 -1.5740 -0.8099 -0.8099 -0.7692 -0.7692 -0.7280 -0.7280 0.3986 0.3986 0.4201 0.4201 0.4958 0.4958 0.6382 0.6382 0.6940 0.6940 0.7732 0.7732 0.8484 0.8484 0.9729 0.9729 1.3657 1.3657 1.7205 1.7205 2.1712 2.1712 2.2403 2.2403 2.2783 2.2783 2.6049 2.6049 3.3889 3.3889 3.4341 3.4341 3.8011 3.8011 7.3763 7.3763 13.2002 13.2002 13.4833 13.4833 13.5598 13.5598 17.3251 17.3251 k = 0.0000 0.0000 0.0736 ( 2789 PWs) bands (ev): -18.0708 -18.0708 -17.3112 -17.3112 -17.3081 -17.3081 -17.2646 -17.2646 -2.4264 -2.4264 -1.5711 -1.5711 -0.8118 -0.8118 -0.7716 -0.7716 -0.7233 -0.7233 0.4031 0.4031 0.4279 0.4279 0.4668 0.4668 0.6364 0.6364 0.6891 0.6891 0.7754 0.7754 0.8430 0.8430 0.9711 0.9711 1.3870 1.3870 1.7026 1.7026 2.1700 2.1700 2.2421 2.2421 2.2797 2.2797 2.6009 2.6009 3.3777 3.3777 3.4229 3.4229 3.7947 3.7947 7.4080 7.4080 13.2053 13.2053 13.5077 13.5077 13.5843 13.5843 17.3269 17.3269 k = 0.0000 0.0000 0.0883 ( 2813 PWs) bands (ev): -18.0673 -18.0673 -17.3108 -17.3108 -17.3076 -17.3076 -17.2651 -17.2651 -2.4179 -2.4179 -1.5677 -1.5677 -0.8143 -0.8143 -0.7746 -0.7746 -0.7176 -0.7176 0.4012 0.4012 0.4373 0.4373 0.4417 0.4417 0.6338 0.6338 0.6829 0.6829 0.7772 0.7772 0.8361 0.8361 0.9687 0.9687 1.4113 1.4113 1.6814 1.6814 2.1685 2.1685 2.2442 2.2442 2.2814 2.2814 2.5960 2.5960 3.3640 3.3640 3.4091 3.4091 3.7867 3.7867 7.4462 7.4462 13.2114 13.2114 13.5373 13.5373 13.6140 13.6140 17.3260 17.3260 k = 0.0000 0.0000 0.1030 ( 2813 PWs) bands (ev): -18.0632 -18.0632 -17.3102 -17.3102 -17.3070 -17.3070 -17.2656 -17.2656 -2.4078 -2.4078 -1.5636 -1.5636 -0.8171 -0.8171 -0.7778 -0.7778 -0.7107 -0.7107 0.3769 0.3769 0.4369 0.4369 0.4481 0.4481 0.6308 0.6308 0.6755 0.6755 0.7787 0.7787 0.8283 0.8283 0.9660 0.9660 1.4379 1.4379 1.6573 1.6573 2.1669 2.1669 2.2466 2.2466 2.2834 2.2834 2.5902 2.5902 3.3483 3.3483 3.3933 3.3933 3.7774 3.7774 7.4909 7.4909 13.2185 13.2185 13.5721 13.5721 13.6488 13.6488 17.3210 17.3210 k = 0.0000 0.0000 0.1177 ( 2805 PWs) bands (ev): -18.0584 -18.0584 -17.3095 -17.3095 -17.3064 -17.3064 -17.2663 -17.2663 -2.3962 -2.3962 -1.5589 -1.5589 -0.8201 -0.8201 -0.7813 -0.7813 -0.7026 -0.7026 0.3388 0.3388 0.4444 0.4444 0.4603 0.4603 0.6275 0.6275 0.6667 0.6667 0.7799 0.7799 0.8195 0.8195 0.9631 0.9631 1.4663 1.4663 1.6306 1.6306 2.1651 2.1651 2.2492 2.2492 2.2856 2.2856 2.5836 2.5836 3.3306 3.3306 3.3755 3.3755 3.7665 3.7665 7.5417 7.5417 13.2263 13.2263 13.6119 13.6119 13.6887 13.6887 17.3130 17.3130 k = 0.0000 0.0000 0.1325 ( 2809 PWs) bands (ev): -18.0530 -18.0530 -17.3088 -17.3088 -17.3057 -17.3057 -17.2670 -17.2670 -2.3832 -2.3832 -1.5537 -1.5537 -0.8234 -0.8234 -0.7850 -0.7850 -0.6934 -0.6934 0.2962 0.2962 0.4552 0.4552 0.4737 0.4737 0.6236 0.6236 0.6563 0.6563 0.7805 0.7805 0.8094 0.8094 0.9596 0.9596 1.4958 1.4958 1.6016 1.6016 2.1631 2.1631 2.2520 2.2520 2.2880 2.2880 2.5761 2.5761 3.3109 3.3109 3.3556 3.3556 3.7542 3.7542 7.5983 7.5983 13.2350 13.2350 13.6565 13.6565 13.7335 13.7335 17.3027 17.3027 k = 0.0000 0.0000 0.1472 ( 2809 PWs) bands (ev): -18.0470 -18.0470 -17.3079 -17.3079 -17.3049 -17.3049 -17.2678 -17.2678 -2.3686 -2.3686 -1.5479 -1.5479 -0.8268 -0.8268 -0.7888 -0.7888 -0.6831 -0.6831 0.2511 0.2511 0.4672 0.4672 0.4882 0.4882 0.6195 0.6195 0.6444 0.6444 0.7810 0.7810 0.7982 0.7982 0.9557 0.9557 1.5262 1.5262 1.5710 1.5710 2.1609 2.1609 2.2550 2.2550 2.2906 2.2906 2.5678 2.5678 3.2894 3.2894 3.3341 3.3341 3.7404 3.7404 7.6606 7.6606 13.2442 13.2442 13.7058 13.7058 13.7829 13.7829 17.2899 17.2899 k = 0.0000 0.0000 0.1619 ( 2809 PWs) bands (ev): -18.0405 -18.0405 -17.3070 -17.3070 -17.3040 -17.3040 -17.2688 -17.2688 -2.3527 -2.3527 -1.5416 -1.5416 -0.8303 -0.8303 -0.7926 -0.7926 -0.6717 -0.6717 0.2045 0.2045 0.4799 0.4799 0.5033 0.5033 0.6154 0.6154 0.6308 0.6308 0.7812 0.7812 0.7859 0.7859 0.9515 0.9515 1.5392 1.5392 1.5570 1.5570 2.1585 2.1585 2.2580 2.2580 2.2932 2.2932 2.5588 2.5588 3.2664 3.2664 3.3109 3.3109 3.7252 3.7252 7.7281 7.7281 13.2539 13.2539 13.7597 13.7597 13.8369 13.8369 17.2743 17.2743 k = 0.0000 0.0000 0.1766 ( 2805 PWs) bands (ev): -18.0333 -18.0333 -17.3060 -17.3060 -17.3030 -17.3030 -17.2699 -17.2699 -2.3353 -2.3353 -1.5347 -1.5347 -0.8337 -0.8337 -0.7963 -0.7963 -0.6592 -0.6592 0.1567 0.1567 0.4922 0.4922 0.5187 0.5187 0.6116 0.6116 0.6159 0.6159 0.7725 0.7725 0.7811 0.7811 0.9471 0.9471 1.5066 1.5066 1.5880 1.5880 2.1560 2.1560 2.2610 2.2610 2.2960 2.2960 2.5490 2.5490 3.2421 3.2421 3.2862 3.2862 3.7085 3.7085 7.8006 7.8006 13.2640 13.2640 13.8180 13.8180 13.8953 13.8953 17.2557 17.2557 k = 0.0000 0.0000 0.1913 ( 2789 PWs) bands (ev): -18.0256 -18.0256 -17.3050 -17.3050 -17.3020 -17.3020 -17.2711 -17.2711 -2.3165 -2.3165 -1.5273 -1.5273 -0.8369 -0.8369 -0.7998 -0.7998 -0.6457 -0.6457 0.1081 0.1081 0.5034 0.5034 0.5329 0.5329 0.6006 0.6006 0.6091 0.6091 0.7581 0.7581 0.7810 0.7810 0.9426 0.9426 1.4739 1.4739 1.6191 1.6191 2.1534 2.1534 2.2641 2.2641 2.2988 2.2988 2.5385 2.5385 3.2166 3.2166 3.2605 3.2605 3.6903 3.6903 7.8778 7.8778 13.2743 13.2743 13.8804 13.8804 13.9579 13.9579 17.2336 17.2336 k = 0.0000 0.0000 0.2061 ( 2789 PWs) bands (ev): -18.0173 -18.0173 -17.3038 -17.3038 -17.3009 -17.3009 -17.2724 -17.2724 -2.2964 -2.2964 -1.5195 -1.5195 -0.8400 -0.8400 -0.8032 -0.8032 -0.6311 -0.6311 0.0589 0.0589 0.5121 0.5121 0.5408 0.5408 0.5898 0.5898 0.6089 0.6089 0.7427 0.7427 0.7804 0.7804 0.9379 0.9379 1.4413 1.4413 1.6498 1.6498 2.1506 2.1506 2.2671 2.2671 2.3016 2.3016 2.5272 2.5272 3.1901 3.1901 3.2336 3.2336 3.6707 3.6707 7.9594 7.9594 13.2847 13.2847 13.9467 13.9467 14.0245 14.0245 17.2080 17.2080 k = 0.0000 0.0000 0.2208 ( 2789 PWs) bands (ev): -18.0085 -18.0085 -17.3027 -17.3027 -17.2998 -17.2998 -17.2739 -17.2739 -2.2750 -2.2750 -1.5114 -1.5114 -0.8429 -0.8429 -0.8062 -0.8062 -0.6155 -0.6155 0.0093 0.0093 0.5166 0.5166 0.5325 0.5325 0.5932 0.5932 0.6124 0.6124 0.7263 0.7263 0.7796 0.7796 0.9332 0.9332 1.4095 1.4095 1.6802 1.6802 2.1476 2.1476 2.2699 2.2699 2.3043 2.3043 2.5153 2.5153 3.1627 3.1627 3.2059 3.2059 3.6496 3.6496 8.0451 8.0451 13.2950 13.2950 14.0169 14.0169 14.0948 14.0948 17.1785 17.1785 k = 0.0000 0.0000 0.2355 ( 2789 PWs) bands (ev): -17.9992 -17.9992 -17.3014 -17.3014 -17.2986 -17.2986 -17.2756 -17.2756 -2.2523 -2.2523 -1.5028 -1.5028 -0.8453 -0.8453 -0.8089 -0.8089 -0.5989 -0.5989 -0.0403 -0.0403 0.5110 0.5110 0.5163 0.5163 0.6072 0.6072 0.6201 0.6201 0.7091 0.7091 0.7785 0.7785 0.9286 0.9286 1.3787 1.3787 1.7101 1.7101 2.1445 2.1445 2.2726 2.2726 2.3070 2.3070 2.5027 2.5027 3.1348 3.1348 3.1774 3.1774 3.6272 3.6272 8.1345 8.1345 13.3051 13.3051 14.0906 14.0906 14.1687 14.1687 17.1451 17.1451 k = 0.0000 0.0000 0.2502 ( 2781 PWs) bands (ev): -17.9894 -17.9894 -17.3001 -17.3001 -17.2973 -17.2973 -17.2775 -17.2775 -2.2284 -2.2284 -1.4939 -1.4939 -0.8474 -0.8474 -0.8111 -0.8111 -0.5814 -0.5814 -0.0900 -0.0900 0.4834 0.4834 0.5116 0.5116 0.6247 0.6247 0.6318 0.6318 0.6913 0.6913 0.7772 0.7772 0.9241 0.9241 1.3494 1.3494 1.7395 1.7395 2.1412 2.1412 2.2751 2.2751 2.3095 2.3095 2.4896 2.4896 3.1066 3.1066 3.1486 3.1486 3.6035 3.6035 8.2275 8.2275 13.3148 13.3148 14.1676 14.1676 14.2459 14.2459 17.1078 17.1078 k = 0.0000 0.0000 0.2649 ( 2773 PWs) bands (ev): -17.9791 -17.9791 -17.2988 -17.2988 -17.2960 -17.2960 -17.2795 -17.2795 -2.2033 -2.2033 -1.4846 -1.4846 -0.8489 -0.8489 -0.8127 -0.8127 -0.5629 -0.5629 -0.1394 -0.1394 0.4518 0.4518 0.5030 0.5030 0.6424 0.6424 0.6461 0.6461 0.6736 0.6736 0.7758 0.7758 0.9197 0.9197 1.3216 1.3216 1.7684 1.7684 2.1378 2.1378 2.2774 2.2774 2.3120 2.3120 2.4760 2.4760 3.0782 3.0782 3.1195 3.1195 3.5785 3.5785 8.3237 8.3237 13.3238 13.3238 14.2478 14.2478 14.3263 14.3263 17.0667 17.0667 k = 0.0000 0.0000 0.2797 ( 2773 PWs) bands (ev): -17.9684 -17.9684 -17.2974 -17.2974 -17.2947 -17.2947 -17.2818 -17.2818 -2.1770 -2.1770 -1.4751 -1.4751 -0.8499 -0.8499 -0.8138 -0.8138 -0.5435 -0.5435 -0.1885 -0.1885 0.4169 0.4169 0.4918 0.4918 0.6462 0.6462 0.6621 0.6621 0.6693 0.6693 0.7739 0.7739 0.9155 0.9155 1.2957 1.2957 1.7965 1.7965 2.1344 2.1344 2.2794 2.2794 2.3142 2.3142 2.4618 2.4618 3.0498 3.0498 3.0903 3.0903 3.5522 3.5522 8.4229 8.4229 13.3322 13.3322 14.3309 14.3309 14.4096 14.4096 17.0220 17.0220 k = 0.0000 0.0000 0.2944 ( 2773 PWs) bands (ev): -17.9572 -17.9572 -17.2961 -17.2961 -17.2933 -17.2933 -17.2842 -17.2842 -2.1497 -2.1497 -1.4653 -1.4653 -0.8502 -0.8502 -0.8141 -0.8141 -0.5232 -0.5232 -0.2370 -0.2370 0.3791 0.3791 0.4784 0.4784 0.6280 0.6280 0.6789 0.6789 0.6865 0.6865 0.7717 0.7717 0.9116 0.9116 1.2716 1.2716 1.8239 1.8239 2.1308 2.1308 2.2811 2.2811 2.3163 2.3163 2.4472 2.4472 3.0217 3.0217 3.0612 3.0612 3.5247 3.5247 8.5248 8.5248 13.3395 13.3395 14.4167 14.4167 14.4956 14.4956 16.9740 16.9740 k = 0.0000 0.0000 0.3091 ( 2773 PWs) bands (ev): -17.9455 -17.9455 -17.2947 -17.2947 -17.2920 -17.2920 -17.2868 -17.2868 -2.1214 -2.1214 -1.4554 -1.4554 -0.8498 -0.8498 -0.8138 -0.8138 -0.5020 -0.5020 -0.2850 -0.2850 0.3387 0.3387 0.4632 0.4632 0.6067 0.6067 0.6961 0.6961 0.7060 0.7060 0.7692 0.7692 0.9081 0.9081 1.2494 1.2494 1.8506 1.8506 2.1272 2.1272 2.2825 2.2825 2.3182 2.3182 2.4322 2.4322 2.9939 2.9939 3.0325 3.0325 3.4961 3.4961 8.6293 8.6293 13.3457 13.3457 14.5049 14.5049 14.5840 14.5840 16.9230 16.9230 k = 0.0000 0.0000 0.3238 ( 2773 PWs) bands (ev): -17.9335 -17.9335 -17.2934 -17.2934 -17.2905 -17.2905 -17.2895 -17.2895 -2.0921 -2.0921 -1.4453 -1.4453 -0.8486 -0.8486 -0.8127 -0.8127 -0.4800 -0.4800 -0.3322 -0.3322 0.2961 0.2961 0.4465 0.4465 0.5841 0.5841 0.7131 0.7131 0.7256 0.7256 0.7664 0.7664 0.9050 0.9050 1.2290 1.2290 1.8765 1.8765 2.1234 2.1234 2.2837 2.2837 2.3198 2.3198 2.4169 2.4169 2.9668 2.9668 3.0041 3.0041 3.4664 3.4664 8.7360 8.7360 13.3506 13.3506 14.5954 14.5954 14.6747 14.6747 16.8695 16.8695 k = 0.0000 0.0000 0.3385 ( 2753 PWs) bands (ev): -17.9210 -17.9210 -17.2937 -17.2937 -17.2909 -17.2909 -17.2891 -17.2891 -2.0619 -2.0619 -1.4349 -1.4349 -0.8467 -0.8467 -0.8108 -0.8108 -0.4573 -0.4573 -0.3783 -0.3783 0.2516 0.2516 0.4286 0.4286 0.5607 0.5607 0.7298 0.7298 0.7451 0.7451 0.7634 0.7634 0.9029 0.9029 1.2106 1.2106 1.9021 1.9021 2.1197 2.1197 2.2845 2.2845 2.3212 2.3212 2.4015 2.4015 2.9405 2.9405 2.9763 2.9763 3.4359 3.4359 8.8449 8.8449 13.3540 13.3540 14.6878 14.6878 14.7673 14.7673 16.8140 16.8140 k = 0.0000 0.0000 0.3532 ( 2765 PWs) bands (ev): -17.9083 -17.9083 -17.2967 -17.2967 -17.2898 -17.2898 -17.2877 -17.2877 -2.0308 -2.0308 -1.4247 -1.4247 -0.8439 -0.8439 -0.8081 -0.8081 -0.4338 -0.4338 -0.4236 -0.4236 0.2053 0.2053 0.4090 0.4090 0.5361 0.5361 0.7449 0.7449 0.7606 0.7606 0.7643 0.7643 0.9008 0.9008 1.1935 1.1935 1.9265 1.9265 2.1158 2.1158 2.2851 2.2851 2.3223 2.3223 2.3859 2.3859 2.9149 2.9149 2.9493 2.9493 3.4043 3.4043 8.9556 8.9556 13.3556 13.3556 14.7821 14.7821 14.8618 14.8618 16.7569 16.7569 k = 0.0000 0.0000 0.3680 ( 2769 PWs) bands (ev): -17.8951 -17.8951 -17.3004 -17.3004 -17.2884 -17.2884 -17.2862 -17.2862 -1.9990 -1.9990 -1.4144 -1.4144 -0.8403 -0.8403 -0.8045 -0.8045 -0.4678 -0.4678 -0.4097 -0.4097 0.1578 0.1578 0.3883 0.3883 0.5109 0.5109 0.7521 0.7521 0.7644 0.7644 0.7829 0.7829 0.8998 0.8998 1.1779 1.1779 1.9503 1.9503 2.1119 2.1119 2.2855 2.2855 2.3230 2.3230 2.3706 2.3706 2.8904 2.8904 2.9230 2.9230 3.3718 3.3718 9.0680 9.0680 13.3553 13.3553 14.8779 14.8779 14.9577 14.9577 16.6987 16.6987 k = 0.0000 0.0000 0.3827 ( 2769 PWs) bands (ev): -17.8817 -17.8817 -17.3043 -17.3043 -17.2869 -17.2869 -17.2848 -17.2848 -1.9665 -1.9665 -1.4042 -1.4042 -0.8357 -0.8357 -0.8000 -0.8000 -0.5107 -0.5107 -0.3851 -0.3851 0.1093 0.1093 0.3665 0.3665 0.4848 0.4848 0.7489 0.7489 0.7768 0.7768 0.8009 0.8009 0.8998 0.8998 1.1635 1.1635 1.9734 1.9734 2.1079 2.1079 2.2857 2.2857 2.3227 2.3227 2.3560 2.3560 2.8669 2.8669 2.8977 2.8977 3.3386 3.3386 9.1819 9.1819 13.3529 13.3529 14.9750 14.9750 15.0550 15.0550 16.6398 16.6398 k = 0.0000 0.0000 0.3974 ( 2769 PWs) bands (ev): -17.8680 -17.8680 -17.3086 -17.3086 -17.2854 -17.2854 -17.2833 -17.2833 -1.9334 -1.9334 -1.3940 -1.3940 -0.8301 -0.8301 -0.7946 -0.7946 -0.5522 -0.5522 -0.3599 -0.3599 0.0603 0.0603 0.3435 0.3435 0.4580 0.4580 0.7439 0.7439 0.7890 0.7890 0.8182 0.8182 0.9011 0.9011 1.1503 1.1503 1.9957 1.9957 2.1040 2.1040 2.2859 2.2859 2.3199 2.3199 2.3440 2.3440 2.8445 2.8445 2.8734 2.8734 3.3047 3.3047 9.2971 9.2971 13.3480 13.3480 15.0732 15.0732 15.1534 15.1534 16.5806 16.5806 k = 0.0000 0.0000 0.4121 ( 2777 PWs) bands (ev): -17.8540 -17.8540 -17.3132 -17.3132 -17.2839 -17.2839 -17.2819 -17.2819 -1.8997 -1.8997 -1.3840 -1.3840 -0.8236 -0.8236 -0.7885 -0.7885 -0.5921 -0.5921 -0.3344 -0.3344 0.0112 0.0112 0.3195 0.3195 0.4304 0.4304 0.7380 0.7380 0.7997 0.7997 0.8347 0.8347 0.9037 0.9037 1.1380 1.1380 2.0173 2.0173 2.1000 2.1000 2.2861 2.2861 2.3115 2.3115 2.3377 2.3377 2.8233 2.8233 2.8500 2.8500 3.2702 3.2702 9.4136 9.4136 13.3406 13.3406 15.1723 15.1723 15.2526 15.2526 16.5216 16.5216 k = 0.0000 0.0000 0.4268 ( 2777 PWs) bands (ev): -17.8398 -17.8398 -17.3181 -17.3181 -17.2824 -17.2824 -17.2804 -17.2804 -1.8656 -1.8656 -1.3741 -1.3741 -0.8160 -0.8160 -0.7815 -0.7815 -0.6302 -0.6302 -0.3089 -0.3089 -0.0377 -0.0377 0.2945 0.2945 0.4021 0.4021 0.7315 0.7315 0.8085 0.8085 0.8504 0.8504 0.9078 0.9078 1.1265 1.1265 2.0383 2.0383 2.0960 2.0960 2.2864 2.2864 2.2986 2.2986 2.3363 2.3363 2.8032 2.8032 2.8276 2.8276 3.2352 3.2352 9.5310 9.5310 13.3304 13.3304 15.2721 15.2721 15.3524 15.3524 16.4630 16.4630 k = 0.0000 0.0000 0.4416 ( 2781 PWs) bands (ev): -17.8253 -17.8253 -17.3234 -17.3234 -17.2809 -17.2809 -17.2790 -17.2790 -1.8311 -1.8311 -1.3645 -1.3645 -0.8073 -0.8073 -0.7743 -0.7743 -0.6659 -0.6659 -0.2840 -0.2840 -0.0854 -0.0854 0.2683 0.2683 0.3729 0.3729 0.7242 0.7242 0.8156 0.8156 0.8650 0.8650 0.9131 0.9131 1.1158 1.1158 2.0586 2.0586 2.0921 2.0921 2.2841 2.2841 2.2870 2.2870 2.3369 2.3369 2.7841 2.7841 2.8063 2.8063 3.1998 3.1998 9.6493 9.6493 13.3172 13.3172 15.3722 15.3722 15.4526 15.4526 16.4053 16.4053 k = 0.0000 0.0000 0.4563 ( 2781 PWs) bands (ev): -17.8107 -17.8107 -17.3289 -17.3289 -17.2795 -17.2795 -17.2777 -17.2777 -1.7964 -1.7964 -1.3551 -1.3551 -0.7976 -0.7976 -0.7684 -0.7684 -0.6977 -0.6977 -0.2615 -0.2615 -0.1299 -0.1299 0.2414 0.2414 0.3433 0.3433 0.7162 0.7162 0.8210 0.8210 0.8788 0.8788 0.9197 0.9197 1.1056 1.1056 2.0781 2.0781 2.0882 2.0882 2.2695 2.2695 2.2879 2.2879 2.3385 2.3385 2.7662 2.7662 2.7860 2.7860 3.1642 3.1642 9.7683 9.7683 13.3007 13.3007 15.4725 15.4725 15.5530 15.5530 16.3487 16.3487 k = 0.0000 0.0000 0.4710 ( 2781 PWs) bands (ev): -17.7959 -17.7959 -17.3349 -17.3349 -17.2780 -17.2780 -17.2763 -17.2763 -1.7615 -1.7615 -1.3461 -1.3461 -0.7869 -0.7869 -0.7694 -0.7694 -0.7197 -0.7197 -0.2491 -0.2491 -0.1636 -0.1636 0.2136 0.2136 0.3131 0.3131 0.7073 0.7073 0.8252 0.8252 0.8915 0.8915 0.9269 0.9269 1.0958 1.0958 2.0844 2.0844 2.0968 2.0968 2.2553 2.2553 2.2893 2.2893 2.3407 2.3407 2.7492 2.7492 2.7666 2.7666 3.1283 3.1283 9.8879 9.8879 13.2807 13.2807 15.5728 15.5728 15.6532 15.6532 16.2934 16.2934 k = 0.0000 0.0000 0.4857 ( 2765 PWs) bands (ev): -17.7810 -17.7810 -17.3412 -17.3412 -17.2766 -17.2766 -17.2750 -17.2750 -1.7266 -1.7266 -1.3373 -1.3373 -0.7863 -0.7863 -0.7749 -0.7749 -0.7228 -0.7228 -0.2648 -0.2648 -0.1683 -0.1683 0.1850 0.1850 0.2826 0.2826 0.6977 0.6977 0.8285 0.8285 0.9032 0.9032 0.9346 0.9346 1.0867 1.0867 2.0807 2.0807 2.1145 2.1145 2.2419 2.2419 2.2912 2.2912 2.3436 2.3436 2.7332 2.7332 2.7482 2.7482 3.0923 3.0923 10.0080 10.0080 13.2570 13.2570 15.6727 15.6727 15.7531 15.7531 16.2397 16.2397 k = 0.0000 0.0000 0.5004 ( 2765 PWs) bands (ev): -17.7659 -17.7659 -17.3478 -17.3478 -17.2753 -17.2753 -17.2737 -17.2737 -1.6917 -1.6917 -1.3291 -1.3291 -0.8117 -0.8117 -0.7620 -0.7620 -0.7144 -0.7144 -0.3022 -0.3022 -0.1503 -0.1503 0.1557 0.1557 0.2517 0.2517 0.6872 0.6872 0.8312 0.8312 0.9138 0.9138 0.9424 0.9424 1.0777 1.0777 2.0771 2.0771 2.1306 2.1306 2.2300 2.2300 2.2937 2.2937 2.3471 2.3471 2.7179 2.7179 2.7305 2.7305 3.0563 3.0563 10.1283 10.1283 13.2294 13.2294 15.7719 15.7719 15.8524 15.8524 16.1879 16.1879 k = 0.0000 0.0000 0.5152 ( 2762 PWs) bands (ev): -17.7508 -17.7508 -17.3548 -17.3548 -17.2740 -17.2740 -17.2725 -17.2725 -1.6570 -1.6570 -1.3213 -1.3213 -0.8382 -0.8382 -0.7480 -0.7480 -0.7020 -0.7020 -0.3452 -0.3452 -0.1258 -0.1258 0.1258 0.1258 0.2207 0.2207 0.6757 0.6757 0.8336 0.8336 0.9233 0.9233 0.9500 0.9500 1.0689 1.0689 2.0737 2.0737 2.1438 2.1438 2.2211 2.2211 2.2968 2.2968 2.3512 2.3512 2.7035 2.7035 2.7136 2.7136 3.0204 3.0204 10.2488 10.2488 13.1976 13.1976 15.8700 15.8700 15.9506 15.9506 16.1381 16.1381 k = 0.0000 0.0000 0.5299 ( 2762 PWs) bands (ev): -17.7356 -17.7356 -17.3622 -17.3622 -17.2727 -17.2727 -17.2713 -17.2713 -1.6226 -1.6226 -1.3140 -1.3140 -0.8636 -0.8636 -0.7329 -0.7329 -0.6874 -0.6874 -0.3893 -0.3893 -0.0997 -0.0997 0.0952 0.0952 0.1899 0.1899 0.6633 0.6633 0.8359 0.8359 0.9317 0.9317 0.9572 0.9572 1.0604 1.0604 2.0703 2.0703 2.1518 2.1518 2.2176 2.2176 2.3007 2.3007 2.3559 2.3559 2.6896 2.6896 2.6974 2.6974 2.9847 2.9847 10.3694 10.3694 13.1615 13.1615 15.9663 15.9663 16.0468 16.0468 16.0915 16.0915 k = 0.0000 0.0000 0.5446 ( 2758 PWs) bands (ev): -17.7204 -17.7204 -17.3700 -17.3700 -17.2715 -17.2715 -17.2702 -17.2702 -1.5887 -1.5887 -1.3072 -1.3072 -0.8872 -0.8872 -0.7168 -0.7168 -0.6712 -0.6712 -0.4330 -0.4330 -0.0738 -0.0738 0.0641 0.0641 0.1598 0.1598 0.6500 0.6500 0.8384 0.8384 0.9389 0.9389 0.9640 0.9640 1.0522 1.0522 2.0672 2.0672 2.1524 2.1524 2.2219 2.2219 2.3054 2.3054 2.3614 2.3614 2.6763 2.6763 2.6818 2.6818 2.9492 2.9492 10.4898 10.4898 13.1210 13.1210 16.0441 16.0441 16.0583 16.0583 16.1444 16.1444 k = 0.0000 0.0000 0.5593 ( 2762 PWs) bands (ev): -17.7052 -17.7052 -17.3781 -17.3781 -17.2703 -17.2703 -17.2691 -17.2691 -1.5554 -1.5554 -1.3011 -1.3011 -0.9089 -0.9089 -0.6998 -0.6998 -0.6538 -0.6538 -0.4758 -0.4758 -0.0495 -0.0495 0.0326 0.0326 0.1317 0.1317 0.6356 0.6356 0.8409 0.8409 0.9450 0.9450 0.9701 0.9701 1.0442 1.0442 2.0642 2.0642 2.1471 2.1471 2.2325 2.2325 2.3108 2.3108 2.3675 2.3675 2.6635 2.6635 2.6669 2.6669 2.9141 2.9141 10.6100 10.6100 13.0758 13.0758 16.0016 16.0016 16.1140 16.1140 16.1886 16.1886 k = 0.0000 0.0000 0.5740 ( 2770 PWs) bands (ev): -17.6901 -17.6901 -17.3866 -17.3866 -17.2693 -17.2693 -17.2681 -17.2681 -1.5229 -1.5229 -1.2954 -1.2954 -0.9284 -0.9284 -0.6818 -0.6818 -0.6351 -0.6351 -0.5174 -0.5174 -0.0299 -0.0299 0.0006 0.0006 0.1083 0.1083 0.6203 0.6203 0.8437 0.8437 0.9498 0.9498 0.9757 0.9757 1.0366 1.0366 2.0614 2.0614 2.1389 2.1389 2.2466 2.2466 2.3170 2.3170 2.3743 2.3743 2.6510 2.6510 2.6523 2.6523 2.8794 2.8794 10.7298 10.7298 13.0260 13.0260 15.9614 15.9614 16.0730 16.0730 16.2616 16.2616 k = 0.0000 0.0000 0.5887 ( 2778 PWs) bands (ev): -17.6749 -17.6749 -17.3956 -17.3956 -17.2682 -17.2682 -17.2672 -17.2672 -1.4915 -1.4915 -1.2904 -1.2904 -0.9454 -0.9454 -0.6633 -0.6633 -0.6152 -0.6152 -0.5574 -0.5574 -0.0318 -0.0318 -0.0212 -0.0212 0.0957 0.0957 0.6039 0.6039 0.8466 0.8466 0.9532 0.9532 0.9806 0.9806 1.0297 1.0297 2.0589 2.0589 2.1297 2.1297 2.2623 2.2623 2.3239 2.3239 2.3817 2.3817 2.6383 2.6383 2.6389 2.6389 2.8454 2.8454 10.8492 10.8492 12.9713 12.9713 15.9238 15.9238 16.0199 16.0199 16.3489 16.3489 k = 0.0000 0.0000 0.6035 ( 2774 PWs) bands (ev): -17.6598 -17.6598 -17.4049 -17.4049 -17.2673 -17.2673 -17.2663 -17.2663 -1.4612 -1.4612 -1.2859 -1.2859 -0.9598 -0.9598 -0.6461 -0.6461 -0.5941 -0.5941 -0.5936 -0.5936 -0.0641 -0.0641 -0.0290 -0.0290 0.0997 0.0997 0.5866 0.5866 0.8501 0.8501 0.9552 0.9552 0.9850 0.9850 1.0236 1.0236 2.0567 2.0567 2.1203 2.1203 2.2789 2.2789 2.3314 2.3314 2.3899 2.3899 2.6248 2.6248 2.6272 2.6272 2.8120 2.8120 10.9678 10.9678 12.9120 12.9120 15.8891 15.8891 15.9696 15.9696 16.4352 16.4352 k = 0.0000 0.0000 0.6182 ( 2786 PWs) bands (ev): -17.6449 -17.6449 -17.4146 -17.4146 -17.2664 -17.2664 -17.2656 -17.2656 -1.4326 -1.4326 -1.2819 -1.2819 -0.9715 -0.9715 -0.6480 -0.6480 -0.6087 -0.6087 -0.5721 -0.5721 -0.0966 -0.0966 -0.0500 -0.0500 0.1170 0.1170 0.5679 0.5679 0.8537 0.8537 0.9556 0.9556 0.9888 0.9888 1.0183 1.0183 2.0548 2.0548 2.1111 2.1111 2.2957 2.2957 2.3395 2.3395 2.3986 2.3986 2.6118 2.6118 2.6157 2.6157 2.7794 2.7794 11.0857 11.0857 12.8479 12.8479 15.8574 15.8574 15.9236 15.9236 16.5188 16.5188 k = 0.0000 0.0000 0.6329 ( 2778 PWs) bands (ev): -17.6300 -17.6300 -17.4246 -17.4246 -17.2656 -17.2656 -17.2649 -17.2649 -1.4056 -1.4056 -1.2787 -1.2787 -0.9799 -0.9799 -0.6788 -0.6788 -0.5924 -0.5924 -0.5489 -0.5489 -0.1290 -0.1290 -0.0773 -0.0773 0.1406 0.1406 0.5485 0.5485 0.8581 0.8581 0.9544 0.9544 0.9922 0.9922 1.0141 1.0141 2.0532 2.0532 2.1025 2.1025 2.3129 2.3129 2.3480 2.3480 2.4080 2.4080 2.5994 2.5994 2.6046 2.6046 2.7476 2.7476 11.2026 11.2026 12.7791 12.7791 15.8287 15.8287 15.8824 15.8824 16.5986 16.5986 k = 0.0000 0.0000 0.6476 ( 2786 PWs) bands (ev): -17.6153 -17.6153 -17.4351 -17.4351 -17.2649 -17.2649 -17.2642 -17.2642 -1.3808 -1.3808 -1.2762 -1.2762 -0.9851 -0.9851 -0.7131 -0.7131 -0.5703 -0.5703 -0.5247 -0.5247 -0.1615 -0.1615 -0.1076 -0.1076 0.1670 0.1670 0.5281 0.5281 0.8627 0.8627 0.9513 0.9513 0.9951 0.9951 1.0111 1.0111 2.0520 2.0520 2.0944 2.0944 2.3299 2.3299 2.3568 2.3568 2.4181 2.4181 2.5875 2.5875 2.5936 2.5936 2.7166 2.7166 11.3183 11.3183 12.7058 12.7058 15.8031 15.8031 15.8459 15.8459 16.6739 16.6739 k = 0.0000 0.0000 0.6623 ( 2786 PWs) bands (ev): -17.6008 -17.6008 -17.4459 -17.4459 -17.2643 -17.2643 -17.2637 -17.2637 -1.3584 -1.3584 -1.2743 -1.2743 -0.9867 -0.9867 -0.7468 -0.7468 -0.5463 -0.5463 -0.4995 -0.4995 -0.1938 -0.1938 -0.1391 -0.1391 0.1946 0.1946 0.5068 0.5068 0.8678 0.8678 0.9468 0.9468 0.9975 0.9975 1.0091 1.0091 2.0512 2.0512 2.0870 2.0870 2.3465 2.3465 2.3659 2.3659 2.4290 2.4290 2.5764 2.5764 2.5830 2.5830 2.6867 2.6867 11.4328 11.4328 12.6280 12.6280 15.7809 15.7809 15.8143 15.8143 16.7438 16.7438 k = 0.0000 0.0000 0.6771 ( 2786 PWs) bands (ev): -17.5864 -17.5864 -17.4570 -17.4570 -17.2637 -17.2637 -17.2633 -17.2633 -1.3387 -1.3387 -1.2732 -1.2732 -0.9844 -0.9844 -0.7793 -0.7793 -0.5212 -0.5212 -0.4734 -0.4734 -0.2260 -0.2260 -0.1710 -0.1710 0.2227 0.2227 0.4845 0.4845 0.8734 0.8734 0.9412 0.9412 0.9995 0.9995 1.0078 1.0078 2.0509 2.0509 2.0803 2.0803 2.3623 2.3623 2.3748 2.3748 2.4409 2.4409 2.5663 2.5663 2.5727 2.5727 2.6578 2.6578 11.5457 11.5457 12.5461 12.5461 15.7620 15.7620 15.7875 15.7875 16.8072 16.8072 k = 0.0000 0.0000 0.6918 ( 2786 PWs) bands (ev): -17.5722 -17.5722 -17.4686 -17.4686 -17.2633 -17.2633 -17.2629 -17.2629 -1.3219 -1.3219 -1.2728 -1.2728 -0.9782 -0.9782 -0.8103 -0.8103 -0.4951 -0.4951 -0.4464 -0.4464 -0.2577 -0.2577 -0.2031 -0.2031 0.2509 0.2509 0.4613 0.4613 0.8793 0.8793 0.9349 0.9349 1.0012 1.0012 1.0070 1.0070 2.0511 2.0511 2.0743 2.0743 2.3765 2.3765 2.3833 2.3833 2.4540 2.4540 2.5576 2.5576 2.5629 2.5629 2.6302 2.6302 11.6570 11.6570 12.4602 12.4602 15.7467 15.7467 15.7655 15.7655 16.8629 16.8629 k = 0.0000 0.0000 0.7065 ( 2786 PWs) bands (ev): -17.5583 -17.5583 -17.4805 -17.4805 -17.2629 -17.2629 -17.2626 -17.2626 -1.3081 -1.3081 -1.2733 -1.2733 -0.9681 -0.9681 -0.8398 -0.8398 -0.4680 -0.4680 -0.4186 -0.4186 -0.2890 -0.2890 -0.2350 -0.2350 0.2789 0.2789 0.4374 0.4374 0.8854 0.8854 0.9280 0.9280 1.0024 1.0024 1.0065 1.0065 2.0518 2.0518 2.0690 2.0690 2.3885 2.3885 2.3911 2.3911 2.4686 2.4686 2.5508 2.5508 2.5536 2.5536 2.6041 2.6041 11.7664 11.7664 12.3704 12.3704 15.7350 15.7350 15.7482 15.7482 16.9097 16.9097 k = 0.0000 0.0000 0.7212 ( 2786 PWs) bands (ev): -17.5446 -17.5446 -17.4927 -17.4927 -17.2626 -17.2626 -17.2624 -17.2624 -1.2970 -1.2970 -1.2749 -1.2749 -0.9541 -0.9541 -0.8674 -0.8674 -0.4402 -0.4402 -0.3906 -0.3906 -0.3194 -0.3194 -0.2666 -0.2666 0.3067 0.3067 0.4126 0.4126 0.8920 0.8920 0.9208 0.9208 1.0035 1.0035 1.0060 1.0060 2.0531 2.0531 2.0645 2.0645 2.3974 2.3974 2.3976 2.3976 2.4848 2.4848 2.5446 2.5446 2.5465 2.5465 2.5803 2.5803 11.8737 11.8737 12.2772 12.2772 15.7270 15.7270 15.7354 15.7354 16.9463 16.9463 k = 0.0000 0.0000 0.7359 ( 2786 PWs) bands (ev): -17.5312 -17.5312 -17.5052 -17.5052 -17.2625 -17.2625 -17.2624 -17.2624 -1.2885 -1.2885 -1.2778 -1.2778 -0.9367 -0.9367 -0.8930 -0.8930 -0.4118 -0.4118 -0.3666 -0.3666 -0.3445 -0.3445 -0.2976 -0.2976 0.3340 0.3340 0.3871 0.3871 0.8989 0.8989 0.9135 0.9135 1.0043 1.0043 1.0056 1.0056 2.0550 2.0550 2.0606 2.0606 2.4022 2.4022 2.4026 2.4026 2.5024 2.5024 2.5344 2.5344 2.5455 2.5455 2.5607 2.5607 11.9786 11.9786 12.1806 12.1806 15.7230 15.7230 15.7270 15.7270 16.9714 16.9714 k = 0.0000 0.0000 0.7507 ( 2774 PWs) bands (ev): -17.5180 -17.5180 -17.5180 -17.5180 -17.2623 -17.2623 -17.2623 -17.2623 -1.2822 -1.2822 -1.2822 -1.2822 -0.9162 -0.9162 -0.9162 -0.9162 -0.3835 -0.3835 -0.3835 -0.3835 -0.3273 -0.3273 -0.3273 -0.3273 0.3609 0.3609 0.3609 0.3609 0.9063 0.9063 0.9063 0.9063 1.0051 1.0051 1.0051 1.0051 2.0575 2.0575 2.0575 2.0575 2.4041 2.4041 2.4041 2.4041 2.5201 2.5201 2.5201 2.5201 2.5493 2.5493 2.5493 2.5493 12.0810 12.0810 12.0810 12.0810 15.7229 15.7229 15.7229 15.7229 16.9839 16.9839 k = 0.0000 0.0000 0.7507 ( 2774 PWs) bands (ev): -17.5180 -17.5180 -17.5180 -17.5180 -17.2623 -17.2623 -17.2623 -17.2623 -1.2822 -1.2822 -1.2822 -1.2822 -0.9162 -0.9162 -0.9162 -0.9162 -0.3835 -0.3835 -0.3835 -0.3835 -0.3273 -0.3273 -0.3273 -0.3273 0.3609 0.3609 0.3609 0.3609 0.9063 0.9063 0.9063 0.9063 1.0051 1.0051 1.0051 1.0051 2.0575 2.0575 2.0575 2.0575 2.4041 2.4041 2.4041 2.4041 2.5201 2.5201 2.5201 2.5201 2.5493 2.5493 2.5493 2.5493 12.0810 12.0810 12.0810 12.0810 15.7229 15.7229 15.7229 15.7229 16.9839 16.9839 k = 0.0000 0.0147 0.7507 ( 2778 PWs) bands (ev): -17.5180 -17.5180 -17.5179 -17.5179 -17.2625 -17.2625 -17.2624 -17.2624 -1.2818 -1.2818 -1.2817 -1.2817 -0.9183 -0.9183 -0.9182 -0.9182 -0.3823 -0.3823 -0.3822 -0.3822 -0.3275 -0.3275 -0.3258 -0.3258 0.3601 0.3601 0.3629 0.3629 0.9058 0.9058 0.9061 0.9061 1.0032 1.0032 1.0058 1.0058 2.0568 2.0568 2.0578 2.0578 2.4006 2.4006 2.4032 2.4032 2.4769 2.4769 2.4961 2.4961 2.5777 2.5777 2.5935 2.5935 12.0813 12.0813 12.0821 12.0821 15.7180 15.7180 15.7205 15.7205 16.9842 16.9842 k = 0.0000 0.0294 0.7507 ( 2788 PWs) bands (ev): -17.5178 -17.5178 -17.5176 -17.5176 -17.2628 -17.2628 -17.2627 -17.2627 -1.2807 -1.2807 -1.2805 -1.2805 -0.9243 -0.9243 -0.9242 -0.9242 -0.3790 -0.3790 -0.3789 -0.3789 -0.3261 -0.3261 -0.3223 -0.3223 0.3607 0.3607 0.3663 0.3663 0.9046 0.9046 0.9050 0.9050 1.0001 1.0001 1.0051 1.0051 2.0557 2.0557 2.0577 2.0577 2.3883 2.3883 2.3942 2.3942 2.4373 2.4373 2.4604 2.4604 2.6278 2.6278 2.6433 2.6433 12.0830 12.0830 12.0845 12.0845 15.7060 15.7060 15.7109 15.7109 16.9869 16.9869 k = 0.0000 0.0441 0.7507 ( 2792 PWs) bands (ev): -17.5173 -17.5173 -17.5171 -17.5171 -17.2632 -17.2632 -17.2631 -17.2631 -1.2787 -1.2787 -1.2784 -1.2784 -0.9340 -0.9340 -0.9339 -0.9339 -0.3751 -0.3751 -0.3743 -0.3743 -0.3226 -0.3226 -0.3161 -0.3161 0.3625 0.3625 0.3709 0.3709 0.9027 0.9027 0.9031 0.9031 0.9961 0.9961 1.0032 1.0032 2.0545 2.0545 2.0569 2.0569 2.3596 2.3596 2.3633 2.3633 2.4200 2.4200 2.4410 2.4410 2.6790 2.6790 2.6942 2.6942 12.0861 12.0861 12.0884 12.0884 15.6870 15.6870 15.6943 15.6943 16.9919 16.9919 k = 0.0000 0.0588 0.7507 ( 2788 PWs) bands (ev): -17.5167 -17.5167 -17.5164 -17.5164 -17.2639 -17.2639 -17.2638 -17.2638 -1.2759 -1.2759 -1.2756 -1.2756 -0.9469 -0.9469 -0.9467 -0.9467 -0.3719 -0.3719 -0.3697 -0.3697 -0.3158 -0.3158 -0.3061 -0.3061 0.3658 0.3658 0.3769 0.3769 0.9002 0.9002 0.9002 0.9002 0.9914 0.9914 1.0002 1.0002 2.0529 2.0529 2.0554 2.0554 2.3190 2.3190 2.3203 2.3203 2.4159 2.4159 2.4343 2.4343 2.7306 2.7306 2.7456 2.7456 12.0906 12.0906 12.0936 12.0936 15.6613 15.6613 15.6708 15.6708 16.9991 16.9991 k = 0.0000 0.0735 0.7507 ( 2792 PWs) bands (ev): -17.5159 -17.5159 -17.5155 -17.5155 -17.2647 -17.2647 -17.2646 -17.2646 -1.2722 -1.2722 -1.2719 -1.2719 -0.9624 -0.9624 -0.9621 -0.9621 -0.3701 -0.3701 -0.3668 -0.3668 -0.3049 -0.3049 -0.2922 -0.2922 0.3701 0.3701 0.3839 0.3839 0.8958 0.8958 0.8967 0.8967 0.9863 0.9863 0.9961 0.9961 2.0511 2.0511 2.0524 2.0524 2.2744 2.2744 2.2763 2.2763 2.4147 2.4147 2.4324 2.4324 2.7824 2.7824 2.7972 2.7972 12.0965 12.0965 12.1002 12.1002 15.6292 15.6292 15.6410 15.6410 17.0084 17.0084 k = 0.0000 0.0882 0.7507 ( 2792 PWs) bands (ev): -17.5150 -17.5150 -17.5144 -17.5144 -17.2657 -17.2657 -17.2656 -17.2656 -1.2678 -1.2678 -1.2676 -1.2676 -0.9801 -0.9801 -0.9797 -0.9797 -0.3700 -0.3700 -0.3658 -0.3658 -0.2900 -0.2900 -0.2746 -0.2746 0.3757 0.3757 0.3922 0.3922 0.8901 0.8901 0.8924 0.8924 0.9812 0.9812 0.9913 0.9913 2.0476 2.0476 2.0488 2.0488 2.2292 2.2292 2.2340 2.2340 2.4142 2.4142 2.4323 2.4323 2.8341 2.8341 2.8487 2.8487 12.1037 12.1037 12.1081 12.1081 15.5912 15.5912 15.6051 15.6051 17.0197 17.0197 k = 0.0000 0.1029 0.7507 ( 2792 PWs) bands (ev): -17.5138 -17.5138 -17.5132 -17.5132 -17.2669 -17.2669 -17.2667 -17.2667 -1.2626 -1.2626 -1.2626 -1.2626 -0.9994 -0.9994 -0.9987 -0.9987 -0.3712 -0.3712 -0.3666 -0.3666 -0.2720 -0.2720 -0.2541 -0.2541 0.3824 0.3824 0.4014 0.4014 0.8826 0.8826 0.8869 0.8869 0.9763 0.9763 0.9858 0.9858 2.0396 2.0396 2.0458 2.0458 2.1846 2.1846 2.1952 2.1952 2.4143 2.4143 2.4332 2.4332 2.8856 2.8856 2.8999 2.8999 12.1123 12.1123 12.1175 12.1175 15.5479 15.5479 15.5637 15.5637 17.0329 17.0329 k = 0.0000 0.1176 0.7507 ( 2792 PWs) bands (ev): -17.5125 -17.5125 -17.5118 -17.5118 -17.2682 -17.2682 -17.2680 -17.2680 -1.2571 -1.2571 -1.2568 -1.2568 -1.0200 -1.0200 -1.0188 -1.0188 -0.3735 -0.3735 -0.3685 -0.3685 -0.2515 -0.2515 -0.2314 -0.2314 0.3901 0.3901 0.4116 0.4116 0.8732 0.8732 0.8802 0.8802 0.9720 0.9720 0.9801 0.9801 2.0266 2.0266 2.0414 2.0414 2.1419 2.1419 2.1619 2.1619 2.4146 2.4146 2.4345 2.4345 2.9367 2.9367 2.9508 2.9508 12.1223 12.1223 12.1281 12.1281 15.4996 15.4996 15.5173 15.5173 17.0478 17.0478 k = 0.0000 0.1324 0.7507 ( 2792 PWs) bands (ev): -17.5110 -17.5110 -17.5102 -17.5102 -17.2697 -17.2697 -17.2695 -17.2695 -1.2510 -1.2510 -1.2502 -1.2502 -1.0413 -1.0413 -1.0395 -1.0395 -0.3766 -0.3766 -0.3715 -0.3715 -0.2294 -0.2294 -0.2071 -0.2071 0.3987 0.3987 0.4225 0.4225 0.8621 0.8621 0.8721 0.8721 0.9684 0.9684 0.9743 0.9743 2.0068 2.0068 2.0333 2.0333 2.1036 2.1036 2.1359 2.1359 2.4152 2.4152 2.4362 2.4362 2.9873 2.9873 3.0012 3.0012 12.1336 12.1336 12.1402 12.1402 15.4470 15.4470 15.4665 15.4665 17.0643 17.0643 k = 0.0000 0.1471 0.7507 ( 2788 PWs) bands (ev): -17.5094 -17.5094 -17.5085 -17.5085 -17.2714 -17.2714 -17.2711 -17.2711 -1.2447 -1.2447 -1.2430 -1.2430 -1.0631 -1.0631 -1.0603 -1.0603 -0.3805 -0.3805 -0.3752 -0.3752 -0.2061 -0.2061 -0.1816 -0.1816 0.4081 0.4081 0.4341 0.4341 0.8493 0.8493 0.8626 0.8626 0.9656 0.9656 0.9688 0.9688 1.9800 1.9800 2.0161 2.0161 2.0752 2.0752 2.1177 2.1177 2.4161 2.4161 2.4381 2.4381 3.0373 3.0373 3.0509 3.0509 12.1463 12.1463 12.1535 12.1535 15.3905 15.3905 15.4116 15.4116 17.0823 17.0823 k = 0.0000 0.1618 0.7507 ( 2792 PWs) bands (ev): -17.5076 -17.5076 -17.5066 -17.5066 -17.2732 -17.2732 -17.2729 -17.2729 -1.2384 -1.2384 -1.2353 -1.2353 -1.0851 -1.0851 -1.0805 -1.0805 -0.3849 -0.3849 -0.3796 -0.3796 -0.1820 -0.1820 -0.1554 -0.1554 0.4181 0.4181 0.4461 0.4461 0.8351 0.8351 0.8515 0.8515 0.9634 0.9634 0.9636 0.9636 1.9479 1.9479 1.9862 1.9862 2.0604 2.0604 2.1055 2.1055 2.4171 2.4171 2.4401 2.4401 3.0864 3.0864 3.0998 3.0998 12.1604 12.1604 12.1682 12.1682 15.3308 15.3308 15.3534 15.3534 17.1018 17.1018 k = 0.0000 0.1765 0.7507 ( 2792 PWs) bands (ev): -17.5057 -17.5057 -17.5046 -17.5046 -17.2751 -17.2751 -17.2748 -17.2748 -1.2326 -1.2326 -1.2271 -1.2271 -1.1068 -1.1068 -1.0996 -1.0996 -0.3899 -0.3899 -0.3845 -0.3845 -0.1574 -0.1574 -0.1285 -0.1285 0.4287 0.4287 0.4582 0.4582 0.8199 0.8199 0.8391 0.8391 0.9589 0.9589 0.9618 0.9618 1.9129 1.9129 1.9499 1.9499 2.0532 2.0532 2.0970 2.0970 2.4183 2.4183 2.4422 2.4422 3.1347 3.1347 3.1478 3.1478 12.1757 12.1757 12.1842 12.1842 15.2684 15.2684 15.2924 15.2924 17.1226 17.1226 k = 0.0000 0.1912 0.7507 ( 2796 PWs) bands (ev): -17.5037 -17.5037 -17.5025 -17.5025 -17.2771 -17.2771 -17.2768 -17.2768 -1.2283 -1.2283 -1.2190 -1.2190 -1.1278 -1.1278 -1.1164 -1.1164 -0.3953 -0.3953 -0.3900 -0.3900 -0.1325 -0.1325 -0.1014 -0.1014 0.4396 0.4396 0.4703 0.4703 0.8042 0.8042 0.8255 0.8255 0.9546 0.9546 0.9607 0.9607 1.8768 1.8768 1.9120 1.9120 2.0485 2.0485 2.0905 2.0905 2.4197 2.4197 2.4444 2.4444 3.1819 3.1819 3.1947 3.1947 12.1923 12.1923 12.2014 12.2014 15.2037 15.2037 15.2290 15.2290 17.1447 17.1447 k = 0.0000 0.2059 0.7507 ( 2792 PWs) bands (ev): -17.5015 -17.5015 -17.5002 -17.5002 -17.2793 -17.2793 -17.2790 -17.2790 -1.2268 -1.2268 -1.2116 -1.2116 -1.1470 -1.1470 -1.1294 -1.1294 -0.4011 -0.4011 -0.3959 -0.3959 -0.1075 -0.1075 -0.0741 -0.0741 0.4506 0.4506 0.4819 0.4819 0.7883 0.7883 0.8110 0.8110 0.9508 0.9508 0.9600 0.9600 1.8405 1.8405 1.8743 1.8743 2.0449 2.0449 2.0851 2.0851 2.4213 2.4213 2.4467 2.4467 3.2280 3.2280 3.2405 3.2405 12.2102 12.2102 12.2198 12.2198 15.1373 15.1373 15.1638 15.1638 17.1679 17.1679 k = 0.0000 0.2206 0.7507 ( 2798 PWs) bands (ev): -17.4992 -17.4992 -17.4979 -17.4979 -17.2816 -17.2816 -17.2813 -17.2813 -1.2299 -1.2299 -1.2077 -1.2077 -1.1619 -1.1619 -1.1368 -1.1368 -0.4074 -0.4074 -0.4023 -0.4023 -0.0825 -0.0825 -0.0469 -0.0469 0.4616 0.4616 0.4928 0.4928 0.7727 0.7727 0.7960 0.7960 0.9473 0.9473 0.9596 0.9596 1.8046 1.8046 1.8373 1.8373 2.0417 2.0417 2.0803 2.0803 2.4229 2.4229 2.4490 2.4490 3.2727 3.2727 3.2849 3.2849 12.2292 12.2292 12.2394 12.2394 15.0697 15.0697 15.0972 15.0972 17.1923 17.1923 k = 0.0000 0.2353 0.7507 ( 2802 PWs) bands (ev): -17.4969 -17.4969 -17.4954 -17.4954 -17.2839 -17.2839 -17.2836 -17.2836 -1.2382 -1.2382 -1.2128 -1.2128 -1.1666 -1.1666 -1.1377 -1.1377 -0.4140 -0.4140 -0.4091 -0.4091 -0.0577 -0.0577 -0.0198 -0.0198 0.4721 0.4721 0.5023 0.5023 0.7580 0.7580 0.7807 0.7807 0.9441 0.9441 0.9595 0.9595 1.7695 1.7695 1.8014 1.8014 2.0385 2.0385 2.0756 2.0756 2.4247 2.4247 2.4513 2.4513 3.3160 3.3160 3.3279 3.3279 12.2494 12.2494 12.2600 12.2600 15.0012 15.0012 15.0298 15.0298 17.2178 17.2178 k = 0.0000 0.2500 0.7507 ( 2798 PWs) bands (ev): -17.4944 -17.4944 -17.4929 -17.4929 -17.2863 -17.2863 -17.2860 -17.2860 -1.2506 -1.2506 -1.2265 -1.2265 -1.1615 -1.1615 -1.1334 -1.1334 -0.4209 -0.4209 -0.4163 -0.4163 -0.0331 -0.0331 0.0070 0.0070 0.4822 0.4822 0.5101 0.5101 0.7448 0.7448 0.7657 0.7657 0.9411 0.9411 0.9597 0.9597 1.7356 1.7356 1.7670 1.7670 2.0355 2.0355 2.0711 2.0711 2.4266 2.4266 2.4537 2.4537 3.3578 3.3578 3.3694 3.3694 12.2706 12.2706 12.2817 12.2817 14.9324 14.9324 14.9619 14.9619 17.2444 17.2444 k = 0.0000 0.2647 0.7507 ( 2808 PWs) bands (ev): -17.4919 -17.4919 -17.4903 -17.4903 -17.2888 -17.2888 -17.2885 -17.2885 -1.2653 -1.2653 -1.2434 -1.2434 -1.1522 -1.1522 -1.1257 -1.1257 -0.4282 -0.4282 -0.4239 -0.4239 -0.0090 -0.0090 0.0335 0.0335 0.4910 0.4910 0.5154 0.5154 0.7336 0.7336 0.7513 0.7513 0.9383 0.9383 0.9600 0.9600 1.7028 1.7028 1.7337 1.7337 2.0324 2.0324 2.0665 2.0665 2.4284 2.4284 2.4559 2.4559 3.3978 3.3978 3.4092 3.4092 12.2928 12.2928 12.3044 12.3044 14.8637 14.8637 14.8941 14.8941 17.2719 17.2719 k = 0.0000 0.2794 0.7507 ( 2798 PWs) bands (ev): -17.4894 -17.4894 -17.4877 -17.4877 -17.2914 -17.2914 -17.2911 -17.2911 -1.2808 -1.2808 -1.2608 -1.2608 -1.1412 -1.1412 -1.1157 -1.1157 -0.4356 -0.4356 -0.4317 -0.4317 0.0147 0.0147 0.0595 0.0595 0.4987 0.4987 0.5180 0.5180 0.7252 0.7252 0.7380 0.7380 0.9357 0.9357 0.9607 0.9607 1.6716 1.6716 1.7022 1.7022 2.0295 2.0295 2.0620 2.0620 2.4304 2.4304 2.4581 2.4581 3.4362 3.4362 3.4473 3.4473 12.3159 12.3159 12.3278 12.3278 14.7955 14.7955 14.8268 14.8268 17.3003 17.3003 k = 0.0000 0.2941 0.7507 ( 2794 PWs) bands (ev): -17.4868 -17.4868 -17.4850 -17.4850 -17.2939 -17.2939 -17.2936 -17.2936 -1.2966 -1.2966 -1.2779 -1.2779 -1.1295 -1.1295 -1.1044 -1.1044 -0.4433 -0.4433 -0.4400 -0.4400 0.0378 0.0378 0.0850 0.0850 0.5046 0.5046 0.5174 0.5174 0.7196 0.7196 0.7262 0.7262 0.9331 0.9331 0.9615 0.9615 1.6418 1.6418 1.6722 1.6722 2.0264 2.0264 2.0574 2.0574 2.4323 2.4323 2.4603 2.4603 3.4726 3.4726 3.4835 3.4835 12.3396 12.3396 12.3519 12.3519 14.7283 14.7283 14.7604 14.7604 17.3295 17.3295 k = 0.0000 0.3088 0.7507 ( 2794 PWs) bands (ev): -17.4843 -17.4843 -17.4824 -17.4824 -17.2965 -17.2965 -17.2962 -17.2962 -1.3119 -1.3119 -1.2942 -1.2942 -1.1173 -1.1173 -1.0922 -1.0922 -0.4513 -0.4513 -0.4485 -0.4485 0.0602 0.0602 0.1098 0.1098 0.5084 0.5084 0.5136 0.5136 0.7162 0.7162 0.7169 0.7169 0.9306 0.9306 0.9625 0.9625 1.6136 1.6136 1.6438 1.6438 2.0233 2.0233 2.0528 2.0528 2.4342 2.4342 2.4624 2.4624 3.5071 3.5071 3.5177 3.5177 12.3639 12.3639 12.3765 12.3765 14.6624 14.6624 14.6953 14.6953 17.3594 17.3594 k = 0.0000 0.3235 0.7507 ( 2794 PWs) bands (ev): -17.4817 -17.4817 -17.4798 -17.4798 -17.2990 -17.2990 -17.2987 -17.2987 -1.3267 -1.3267 -1.3096 -1.3096 -1.1050 -1.1050 -1.0796 -1.0796 -0.4593 -0.4593 -0.4572 -0.4572 0.0819 0.0819 0.1339 0.1339 0.5073 0.5073 0.5098 0.5098 0.7085 0.7085 0.7167 0.7167 0.9281 0.9281 0.9636 0.9636 1.5872 1.5872 1.6172 1.6172 2.0202 2.0202 2.0482 2.0482 2.4361 2.4361 2.4644 2.4644 3.5394 3.5394 3.5497 3.5497 12.3886 12.3886 12.4014 12.4014 14.5984 14.5984 14.6319 14.6319 17.3900 17.3900 k = 0.0000 0.3382 0.7507 ( 2794 PWs) bands (ev): -17.4792 -17.4792 -17.4772 -17.4772 -17.3015 -17.3015 -17.3012 -17.3012 -1.3406 -1.3406 -1.3241 -1.3241 -1.0926 -1.0926 -1.0668 -1.0668 -0.4673 -0.4673 -0.4660 -0.4660 0.1027 0.1027 0.1572 0.1572 0.4989 0.4989 0.5088 0.5088 0.7030 0.7030 0.7183 0.7183 0.9257 0.9257 0.9648 0.9648 1.5625 1.5625 1.5925 1.5925 2.0172 2.0172 2.0436 2.0436 2.4379 2.4379 2.4663 2.4663 3.5696 3.5696 3.5796 3.5796 12.4134 12.4134 12.4264 12.4264 14.5366 14.5366 14.5708 14.5708 17.4210 17.4210 k = 0.0000 0.3529 0.7507 ( 2792 PWs) bands (ev): -17.4768 -17.4768 -17.4747 -17.4747 -17.3039 -17.3039 -17.3037 -17.3037 -1.3536 -1.3536 -1.3375 -1.3375 -1.0805 -1.0805 -1.0539 -1.0539 -0.4754 -0.4754 -0.4749 -0.4749 0.1224 0.1224 0.1795 0.1795 0.4893 0.4893 0.5056 0.5056 0.6998 0.6998 0.7212 0.7212 0.9233 0.9233 0.9661 0.9661 1.5398 1.5398 1.5696 1.5696 2.0143 2.0143 2.0391 2.0391 2.4397 2.4397 2.4681 2.4681 3.5974 3.5974 3.6072 3.6072 12.4380 12.4380 12.4512 12.4512 14.4775 14.4775 14.5124 14.5124 17.4524 17.4524 k = 0.0000 0.3676 0.7507 ( 2800 PWs) bands (ev): -17.4745 -17.4745 -17.4723 -17.4723 -17.3062 -17.3062 -17.3060 -17.3060 -1.3656 -1.3656 -1.3498 -1.3498 -1.0687 -1.0687 -1.0412 -1.0412 -0.4838 -0.4838 -0.4833 -0.4833 0.1410 0.1410 0.2008 0.2008 0.4790 0.4790 0.5004 0.5004 0.6983 0.6983 0.7246 0.7246 0.9209 0.9209 0.9675 0.9675 1.5190 1.5190 1.5487 1.5487 2.0115 2.0115 2.0348 2.0348 2.4413 2.4413 2.4697 2.4697 3.6229 3.6229 3.6325 3.6325 12.4622 12.4622 12.4755 12.4755 14.4216 14.4216 14.4572 14.4572 17.4837 17.4837 k = 0.0000 0.3824 0.7507 ( 2790 PWs) bands (ev): -17.4723 -17.4723 -17.4700 -17.4700 -17.3084 -17.3084 -17.3082 -17.3082 -1.3764 -1.3764 -1.3608 -1.3608 -1.0573 -1.0573 -1.0288 -1.0288 -0.4924 -0.4924 -0.4909 -0.4909 0.1584 0.1584 0.2209 0.2209 0.4686 0.4686 0.4939 0.4939 0.6983 0.6983 0.7284 0.7284 0.9188 0.9188 0.9690 0.9690 1.5003 1.5003 1.5299 1.5299 2.0089 2.0089 2.0307 2.0307 2.4428 2.4428 2.4713 2.4713 3.6459 3.6459 3.6553 3.6553 12.4856 12.4856 12.4990 12.4990 14.3695 14.3695 14.4057 14.4057 17.5148 17.5148 k = 0.0000 0.3971 0.7507 ( 2790 PWs) bands (ev): -17.4702 -17.4702 -17.4679 -17.4679 -17.3104 -17.3104 -17.3103 -17.3103 -1.3860 -1.3860 -1.3707 -1.3707 -1.0466 -1.0466 -1.0172 -1.0172 -0.5007 -0.5007 -0.4982 -0.4982 0.1744 0.1744 0.2396 0.2396 0.4586 0.4586 0.4866 0.4866 0.6991 0.6991 0.7319 0.7319 0.9167 0.9167 0.9704 0.9704 1.4837 1.4837 1.5131 1.5131 2.0064 2.0064 2.0270 2.0270 2.4442 2.4442 2.4726 2.4726 3.6664 3.6664 3.6756 3.6756 12.5078 12.5078 12.5212 12.5212 14.3216 14.3216 14.3583 14.3583 17.5451 17.5451 k = 0.0000 0.4118 0.7507 ( 2790 PWs) bands (ev): -17.4684 -17.4684 -17.4660 -17.4660 -17.3122 -17.3122 -17.3121 -17.3121 -1.3945 -1.3945 -1.3793 -1.3793 -1.0369 -1.0369 -1.0064 -1.0064 -0.5085 -0.5085 -0.5050 -0.5050 0.1887 0.1887 0.2568 0.2568 0.4493 0.4493 0.4789 0.4789 0.7003 0.7003 0.7351 0.7351 0.9149 0.9149 0.9718 0.9718 1.4692 1.4692 1.4985 1.4985 2.0042 2.0042 2.0235 2.0235 2.4454 2.4454 2.4738 2.4738 3.6843 3.6843 3.6934 3.6934 12.5284 12.5284 12.5418 12.5418 14.2785 14.2785 14.3158 14.3158 17.5743 17.5743 k = 0.0000 0.4265 0.7507 ( 2790 PWs) bands (ev): -17.4668 -17.4668 -17.4643 -17.4643 -17.3138 -17.3138 -17.3138 -17.3138 -1.4017 -1.4017 -1.3866 -1.3866 -1.0282 -1.0282 -0.9967 -0.9967 -0.5156 -0.5156 -0.5111 -0.5111 0.2012 0.2012 0.2723 0.2723 0.4410 0.4410 0.4713 0.4713 0.7017 0.7017 0.7378 0.7378 0.9132 0.9132 0.9731 0.9731 1.4570 1.4570 1.4861 1.4861 2.0022 2.0022 2.0205 2.0205 2.4464 2.4464 2.4748 2.4748 3.6995 3.6995 3.7085 3.7085 12.5469 12.5469 12.5602 12.5602 14.2408 14.2408 14.2785 14.2785 17.6015 17.6015 k = 0.0000 0.4412 0.7507 ( 2794 PWs) bands (ev): -17.4654 -17.4654 -17.4629 -17.4629 -17.3152 -17.3152 -17.3151 -17.3151 -1.4076 -1.4076 -1.3926 -1.3926 -1.0209 -1.0209 -0.9884 -0.9884 -0.5218 -0.5218 -0.5164 -0.5164 0.2118 0.2118 0.2857 0.2857 0.4339 0.4339 0.4643 0.4643 0.7030 0.7030 0.7399 0.7399 0.9118 0.9118 0.9741 0.9741 1.4470 1.4470 1.4759 1.4759 2.0006 2.0006 2.0179 2.0179 2.4473 2.4473 2.4756 2.4756 3.7120 3.7120 3.7208 3.7208 12.5628 12.5628 12.5761 12.5761 14.2090 14.2090 14.2472 14.2472 17.6260 17.6260 k = 0.0000 0.4559 0.7507 ( 2794 PWs) bands (ev): -17.4643 -17.4643 -17.4618 -17.4618 -17.3163 -17.3163 -17.3163 -17.3163 -1.4122 -1.4122 -1.3973 -1.3973 -1.0149 -1.0149 -0.9816 -0.9816 -0.5269 -0.5269 -0.5207 -0.5207 0.2203 0.2203 0.2967 0.2967 0.4282 0.4282 0.4581 0.4581 0.7041 0.7041 0.7415 0.7415 0.9106 0.9106 0.9750 0.9750 1.4392 1.4392 1.4680 1.4680 1.9992 1.9992 2.0159 2.0159 2.4479 2.4479 2.4763 2.4763 3.7218 3.7218 3.7305 3.7305 12.5758 12.5758 12.5890 12.5890 14.1836 14.1836 14.2221 14.2221 17.6467 17.6467 k = 0.0000 0.4706 0.7507 ( 2794 PWs) bands (ev): -17.4635 -17.4635 -17.4609 -17.4609 -17.3171 -17.3171 -17.3171 -17.3171 -1.4156 -1.4156 -1.4006 -1.4006 -1.0105 -1.0105 -0.9766 -0.9766 -0.5307 -0.5307 -0.5239 -0.5239 0.2265 0.2265 0.3051 0.3051 0.4240 0.4240 0.4533 0.4533 0.7049 0.7049 0.7426 0.7426 0.9098 0.9098 0.9756 0.9756 1.4336 1.4336 1.4623 1.4623 1.9983 1.9983 2.0144 2.0144 2.4484 2.4484 2.4768 2.4768 3.7288 3.7288 3.7375 3.7375 12.5854 12.5854 12.5985 12.5985 14.1651 14.1651 14.2039 14.2039 17.6626 17.6626 k = 0.0000 0.4853 0.7507 ( 2804 PWs) bands (ev): -17.4630 -17.4630 -17.4604 -17.4604 -17.3176 -17.3176 -17.3176 -17.3176 -1.4176 -1.4176 -1.4026 -1.4026 -1.0079 -1.0079 -0.9736 -0.9736 -0.5330 -0.5330 -0.5258 -0.5258 0.2302 0.2302 0.3102 0.3102 0.4215 0.4215 0.4502 0.4502 0.7053 0.7053 0.7432 0.7432 0.9092 0.9092 0.9760 0.9760 1.4303 1.4303 1.4589 1.4589 1.9977 1.9977 2.0134 2.0134 2.4487 2.4487 2.4771 2.4771 3.7330 3.7330 3.7416 3.7416 12.5913 12.5913 12.6044 12.6044 14.1539 14.1539 14.1928 14.1928 17.6726 17.6726 k = 0.0000 0.5000 0.7507 ( 2804 PWs) bands (ev): -17.4628 -17.4628 -17.4603 -17.4603 -17.3177 -17.3177 -17.3177 -17.3177 -1.4182 -1.4182 -1.4033 -1.4033 -1.0070 -1.0070 -0.9725 -0.9725 -0.5338 -0.5338 -0.5265 -0.5265 0.2314 0.2314 0.3120 0.3120 0.4206 0.4206 0.4491 0.4491 0.7055 0.7055 0.7434 0.7434 0.9090 0.9090 0.9761 0.9761 1.4291 1.4291 1.4577 1.4577 1.9975 1.9975 2.0131 2.0131 2.4488 2.4488 2.4771 2.4771 3.7344 3.7344 3.7430 3.7430 12.5932 12.5932 12.6063 12.6063 14.1501 14.1501 14.1891 14.1891 17.6760 17.6760 k = 0.0000 0.5000 0.7507 ( 2804 PWs) bands (ev): -17.4628 -17.4628 -17.4603 -17.4603 -17.3177 -17.3177 -17.3177 -17.3177 -1.4182 -1.4182 -1.4033 -1.4033 -1.0070 -1.0070 -0.9725 -0.9725 -0.5338 -0.5338 -0.5265 -0.5265 0.2314 0.2314 0.3120 0.3120 0.4206 0.4206 0.4491 0.4491 0.7055 0.7055 0.7434 0.7434 0.9090 0.9090 0.9761 0.9761 1.4291 1.4291 1.4577 1.4577 1.9975 1.9975 2.0131 2.0131 2.4488 2.4488 2.4771 2.4771 3.7344 3.7344 3.7430 3.7430 12.5932 12.5932 12.6063 12.6063 14.1501 14.1501 14.1891 14.1891 17.6760 17.6760 k = 0.0147 0.5000 0.7507 ( 2804 PWs) bands (ev): -17.4629 -17.4629 -17.4603 -17.4603 -17.3177 -17.3177 -17.3177 -17.3177 -1.4188 -1.4188 -1.4039 -1.4039 -1.0075 -1.0075 -0.9730 -0.9730 -0.5334 -0.5334 -0.5263 -0.5263 0.2279 0.2279 0.3054 0.3054 0.4255 0.4255 0.4507 0.4507 0.7066 0.7066 0.7451 0.7451 0.9098 0.9098 0.9763 0.9763 1.4308 1.4308 1.4593 1.4593 1.9979 1.9979 2.0135 2.0135 2.4487 2.4487 2.4770 2.4770 3.7336 3.7336 3.7422 3.7422 12.5913 12.5913 12.6044 12.6044 14.1522 14.1522 14.1912 14.1912 17.6605 17.6605 k = 0.0294 0.5000 0.7507 ( 2804 PWs) bands (ev): -17.4630 -17.4630 -17.4604 -17.4604 -17.3176 -17.3176 -17.3176 -17.3176 -1.4205 -1.4205 -1.4055 -1.4055 -1.0091 -1.0091 -0.9742 -0.9742 -0.5323 -0.5323 -0.5256 -0.5256 0.2178 0.2178 0.2883 0.2883 0.4374 0.4374 0.4553 0.4553 0.7098 0.7098 0.7502 0.7502 0.9122 0.9122 0.9768 0.9768 1.4357 1.4357 1.4639 1.4639 1.9992 1.9992 2.0147 2.0147 2.4484 2.4484 2.4767 2.4767 3.7311 3.7311 3.7397 3.7397 12.5857 12.5857 12.5984 12.5984 14.1586 14.1586 14.1973 14.1973 17.6186 17.6186 k = 0.0441 0.5000 0.7507 ( 2804 PWs) bands (ev): -17.4631 -17.4631 -17.4606 -17.4606 -17.3174 -17.3174 -17.3173 -17.3173 -1.4233 -1.4233 -1.4082 -1.4082 -1.0117 -1.0117 -0.9761 -0.9761 -0.5304 -0.5304 -0.5245 -0.5245 0.2021 0.2021 0.2651 0.2651 0.4521 0.4521 0.4619 0.4619 0.7149 0.7149 0.7584 0.7584 0.9162 0.9162 0.9777 0.9777 1.4439 1.4439 1.4716 1.4716 2.0013 2.0013 2.0167 2.0167 2.4480 2.4480 2.4761 2.4761 3.7270 3.7270 3.7356 3.7356 12.5764 12.5764 12.5887 12.5887 14.1691 14.1691 14.2075 14.2075 17.5600 17.5600 k = 0.0588 0.5000 0.7507 ( 2800 PWs) bands (ev): -17.4633 -17.4633 -17.4608 -17.4608 -17.3171 -17.3171 -17.3170 -17.3170 -1.4273 -1.4273 -1.4121 -1.4121 -1.0150 -1.0150 -0.9787 -0.9787 -0.5280 -0.5280 -0.5231 -0.5231 0.1821 0.1821 0.2385 0.2385 0.4668 0.4668 0.4696 0.4696 0.7221 0.7221 0.7694 0.7694 0.9217 0.9217 0.9791 0.9791 1.4553 1.4553 1.4823 1.4823 2.0043 2.0043 2.0194 2.0194 2.4473 2.4473 2.4752 2.4752 3.7213 3.7213 3.7298 3.7298 12.5636 12.5636 12.5754 12.5754 14.1836 14.1836 14.2216 14.2216 17.4924 17.4924 k = 0.0735 0.5000 0.7507 ( 2800 PWs) bands (ev): -17.4636 -17.4636 -17.4611 -17.4611 -17.3167 -17.3167 -17.3167 -17.3167 -1.4324 -1.4324 -1.4170 -1.4170 -1.0190 -1.0190 -0.9817 -0.9817 -0.5251 -0.5251 -0.5214 -0.5214 0.1589 0.1589 0.2099 0.2099 0.4778 0.4778 0.4806 0.4806 0.7310 0.7310 0.7825 0.7825 0.9286 0.9286 0.9809 0.9809 1.4699 1.4699 1.4961 1.4961 2.0081 2.0081 2.0229 2.0229 2.4465 2.4465 2.4741 2.4741 3.7140 3.7140 3.7223 3.7223 12.5475 12.5475 12.5587 12.5587 14.2019 14.2019 14.2393 14.2393 17.4206 17.4206 k = 0.0882 0.5000 0.7507 ( 2804 PWs) bands (ev): -17.4639 -17.4639 -17.4614 -17.4614 -17.3162 -17.3162 -17.3162 -17.3162 -1.4386 -1.4386 -1.4232 -1.4232 -1.0233 -1.0233 -0.9851 -0.9851 -0.5219 -0.5219 -0.5196 -0.5196 0.1333 0.1333 0.1800 0.1800 0.4859 0.4859 0.4929 0.4929 0.7413 0.7413 0.7971 0.7971 0.9368 0.9368 0.9834 0.9834 1.4877 1.4877 1.5129 1.5129 2.0127 2.0127 2.0271 2.0271 2.4454 2.4454 2.4728 2.4728 3.7049 3.7049 3.7131 3.7131 12.5285 12.5285 12.5390 12.5390 14.2237 14.2237 14.2606 14.2606 17.3475 17.3475 k = 0.1029 0.5000 0.7507 ( 2804 PWs) bands (ev): -17.4642 -17.4642 -17.4618 -17.4618 -17.3157 -17.3157 -17.3157 -17.3157 -1.4460 -1.4460 -1.4304 -1.4304 -1.0277 -1.0277 -0.9885 -0.9885 -0.5186 -0.5186 -0.5178 -0.5178 0.1061 0.1061 0.1492 0.1492 0.4938 0.4938 0.5035 0.5035 0.7527 0.7527 0.8128 0.8128 0.9463 0.9463 0.9866 0.9866 1.5087 1.5087 1.5329 1.5329 2.0181 2.0181 2.0320 2.0320 2.4442 2.4442 2.4712 2.4712 3.6943 3.6943 3.7023 3.7023 12.5068 12.5068 12.5165 12.5165 14.2489 14.2489 14.2851 14.2851 17.2746 17.2746 k = 0.1176 0.5000 0.7507 ( 2800 PWs) bands (ev): -17.4646 -17.4646 -17.4623 -17.4623 -17.3151 -17.3151 -17.3151 -17.3151 -1.4544 -1.4544 -1.4389 -1.4389 -1.0320 -1.0320 -0.9917 -0.9917 -0.5160 -0.5160 -0.5152 -0.5152 0.0779 0.0779 0.1181 0.1181 0.5012 0.5012 0.5126 0.5126 0.7648 0.7648 0.8288 0.8288 0.9570 0.9570 0.9908 0.9908 1.5326 1.5326 1.5557 1.5557 2.0243 2.0243 2.0377 2.0377 2.4427 2.4427 2.4693 2.4693 3.6820 3.6820 3.6899 3.6899 12.4828 12.4828 12.4917 12.4917 14.2771 14.2771 14.3126 14.3126 17.2029 17.2029 k = 0.1324 0.5000 0.7507 ( 2800 PWs) bands (ev): -17.4651 -17.4651 -17.4627 -17.4627 -17.3145 -17.3145 -17.3144 -17.3144 -1.4638 -1.4638 -1.4484 -1.4484 -1.0359 -1.0359 -0.9947 -0.9947 -0.5145 -0.5145 -0.5120 -0.5120 0.0490 0.0490 0.0868 0.0868 0.5082 0.5082 0.5203 0.5203 0.7773 0.7773 0.8444 0.8444 0.9689 0.9689 0.9962 0.9962 1.5593 1.5593 1.5814 1.5814 2.0312 2.0312 2.0440 2.0440 2.4411 2.4411 2.4672 2.4672 3.6682 3.6682 3.6759 3.6759 12.4567 12.4567 12.4648 12.4648 14.3081 14.3081 14.3429 14.3429 17.1331 17.1331 k = 0.1471 0.5000 0.7507 ( 2800 PWs) bands (ev): -17.4655 -17.4655 -17.4633 -17.4633 -17.3138 -17.3138 -17.3137 -17.3137 -1.4742 -1.4742 -1.4590 -1.4590 -1.0392 -1.0392 -0.9973 -0.9973 -0.5134 -0.5134 -0.5091 -0.5091 0.0199 0.0199 0.0556 0.0556 0.5146 0.5146 0.5267 0.5267 0.7897 0.7897 0.8592 0.8592 0.9817 0.9817 1.0030 1.0030 1.5889 1.5889 1.6099 1.6099 2.0388 2.0388 2.0509 2.0509 2.4392 2.4392 2.4649 2.4649 3.6527 3.6527 3.6602 3.6602 12.4290 12.4290 12.4362 12.4362 14.3416 14.3416 14.3758 14.3758 17.0654 17.0654 k = 0.1618 0.5000 0.7507 ( 2796 PWs) bands (ev): -17.4660 -17.4660 -17.4638 -17.4638 -17.3131 -17.3131 -17.3130 -17.3130 -1.4855 -1.4855 -1.4706 -1.4706 -1.0419 -1.0419 -0.9993 -0.9993 -0.5126 -0.5126 -0.5066 -0.5066 -0.0092 -0.0092 0.0246 0.0246 0.5206 0.5206 0.5321 0.5321 0.8019 0.8019 0.8725 0.8725 0.9955 0.9955 1.0116 1.0116 1.6211 1.6211 1.6410 1.6410 2.0471 2.0471 2.0585 2.0585 2.4371 2.4371 2.4622 2.4622 3.6357 3.6357 3.6429 3.6429 12.3999 12.3999 12.4063 12.4063 14.3775 14.3775 14.4111 14.4111 17.0002 17.0002 k = 0.1765 0.5000 0.7507 ( 2796 PWs) bands (ev): -17.4665 -17.4665 -17.4644 -17.4644 -17.3123 -17.3123 -17.3122 -17.3122 -1.4976 -1.4976 -1.4830 -1.4830 -1.0437 -1.0437 -1.0007 -1.0007 -0.5125 -0.5125 -0.5047 -0.5047 -0.0380 -0.0380 -0.0059 -0.0059 0.5261 0.5261 0.5367 0.5367 0.8135 0.8135 0.8841 0.8841 1.0101 1.0101 1.0220 1.0220 1.6556 1.6556 1.6746 1.6746 2.0560 2.0560 2.0666 2.0666 2.4348 2.4348 2.4592 2.4592 3.6171 3.6171 3.6241 3.6241 12.3698 12.3698 12.3754 12.3754 14.4155 14.4155 14.4485 14.4485 16.9375 16.9376 k = 0.1912 0.5000 0.7507 ( 2792 PWs) bands (ev): -17.4671 -17.4671 -17.4650 -17.4650 -17.3115 -17.3115 -17.3114 -17.3114 -1.5103 -1.5103 -1.4962 -1.4962 -1.0447 -1.0447 -1.0013 -1.0013 -0.5130 -0.5130 -0.5034 -0.5034 -0.0662 -0.0662 -0.0358 -0.0358 0.5311 0.5311 0.5406 0.5406 0.8245 0.8245 0.8938 0.8938 1.0253 1.0253 1.0341 1.0341 1.6924 1.6924 1.7105 1.7105 2.0655 2.0655 2.0752 2.0752 2.4322 2.4322 2.4560 2.4560 3.5970 3.5970 3.6037 3.6037 12.3390 12.3390 12.3438 12.3438 14.4554 14.4554 14.4880 14.4880 16.8776 16.8776 k = 0.2059 0.5000 0.7507 ( 2792 PWs) bands (ev): -17.4676 -17.4676 -17.4656 -17.4656 -17.3106 -17.3106 -17.3105 -17.3105 -1.5235 -1.5235 -1.5101 -1.5101 -1.0447 -1.0447 -1.0011 -1.0011 -0.5143 -0.5143 -0.5029 -0.5029 -0.0937 -0.0937 -0.0648 -0.0648 0.5357 0.5357 0.5438 0.5438 0.8347 0.8347 0.9016 0.9016 1.0411 1.0411 1.0477 1.0477 1.7312 1.7312 1.7485 1.7485 2.0756 2.0756 2.0844 2.0844 2.4294 2.4294 2.4524 2.4524 3.5753 3.5753 3.5818 3.5818 12.3077 12.3077 12.3118 12.3118 14.4971 14.4971 14.5292 14.5292 16.8204 16.8204 k = 0.2206 0.5000 0.7507 ( 2792 PWs) bands (ev): -17.4682 -17.4682 -17.4663 -17.4663 -17.3098 -17.3098 -17.3097 -17.3097 -1.5372 -1.5372 -1.5244 -1.5244 -1.0437 -1.0437 -1.0001 -1.0001 -0.5166 -0.5166 -0.5034 -0.5034 -0.1201 -0.1201 -0.0929 -0.0929 0.5398 0.5398 0.5465 0.5465 0.8440 0.8440 0.9077 0.9077 1.0572 1.0572 1.0625 1.0625 1.7719 1.7719 1.7885 1.7885 2.0862 2.0862 2.0940 2.0940 2.4263 2.4263 2.4486 2.4486 3.5522 3.5522 3.5583 3.5583 12.2763 12.2763 12.2797 12.2797 14.5404 14.5404 14.5721 14.5721 16.7655 16.7658 k = 0.2353 0.5000 0.7507 ( 2780 PWs) bands (ev): -17.4687 -17.4687 -17.4669 -17.4669 -17.3089 -17.3089 -17.3088 -17.3088 -1.5510 -1.5510 -1.5389 -1.5389 -1.0418 -1.0418 -0.9983 -0.9983 -0.5198 -0.5198 -0.5048 -0.5048 -0.1453 -0.1453 -0.1197 -0.1197 0.5435 0.5435 0.5488 0.5488 0.8527 0.8527 0.9126 0.9126 1.0736 1.0736 1.0782 1.0782 1.8142 1.8142 1.8302 1.8302 2.0974 2.0974 2.1040 2.1040 2.4229 2.4229 2.4444 2.4444 3.5276 3.5276 3.5334 3.5334 12.2449 12.2449 12.2478 12.2478 14.5851 14.5851 14.6165 14.6165 16.7093 16.7094 k = 0.2500 0.5000 0.7507 ( 2784 PWs) bands (ev): -17.4693 -17.4693 -17.4676 -17.4676 -17.3080 -17.3080 -17.3079 -17.3079 -1.5651 -1.5651 -1.5537 -1.5537 -1.0389 -1.0389 -0.9956 -0.9956 -0.5243 -0.5243 -0.5075 -0.5075 -0.1690 -0.1690 -0.1452 -0.1452 0.5467 0.5467 0.5507 0.5507 0.8604 0.8604 0.9163 0.9163 1.0899 1.0899 1.0941 1.0941 1.8578 1.8578 1.8734 1.8734 2.1091 2.1091 2.1144 2.1144 2.4193 2.4193 2.4399 2.4399 3.5016 3.5016 3.5071 3.5071 12.2139 12.2139 12.2162 12.2162 14.6312 14.6312 14.6622 14.6622 16.6559 16.6559 k = 0.2647 0.5000 0.7507 ( 2784 PWs) bands (ev): -17.4698 -17.4698 -17.4682 -17.4682 -17.3072 -17.3072 -17.3071 -17.3071 -1.5790 -1.5790 -1.5684 -1.5684 -1.0351 -1.0351 -0.9922 -0.9922 -0.5300 -0.5300 -0.5114 -0.5114 -0.1911 -0.1911 -0.1691 -0.1691 0.5496 0.5496 0.5524 0.5524 0.8674 0.8674 0.9191 0.9191 1.1061 1.1061 1.1101 1.1101 1.9024 1.9024 1.9179 1.9179 2.1213 2.1213 2.1251 2.1251 2.4154 2.4154 2.4351 2.4351 3.4741 3.4741 3.4793 3.4793 12.1835 12.1835 12.1853 12.1853 14.6784 14.6784 14.7092 14.7092 16.6049 16.6049 k = 0.2794 0.5000 0.7507 ( 2780 PWs) bands (ev): -17.4704 -17.4704 -17.4688 -17.4688 -17.3063 -17.3063 -17.3062 -17.3062 -1.5928 -1.5928 -1.5829 -1.5829 -1.0305 -1.0305 -0.9880 -0.9880 -0.5370 -0.5370 -0.5166 -0.5166 -0.2113 -0.2113 -0.1912 -0.1912 0.5521 0.5521 0.5538 0.5538 0.8738 0.8738 0.9214 0.9214 1.1220 1.1220 1.1260 1.1260 1.9478 1.9478 1.9635 1.9635 2.1341 2.1341 2.1362 2.1362 2.4112 2.4112 2.4299 2.4299 3.4455 3.4455 3.4503 3.4503 12.1538 12.1538 12.1552 12.1552 14.7266 14.7266 14.7573 14.7573 16.5563 16.5563 k = 0.2941 0.5000 0.7507 ( 2784 PWs) bands (ev): -17.4709 -17.4709 -17.4695 -17.4695 -17.3055 -17.3055 -17.3054 -17.3054 -1.6063 -1.6063 -1.5972 -1.5972 -1.0250 -1.0250 -0.9832 -0.9832 -0.5454 -0.5454 -0.5233 -0.5233 -0.2296 -0.2296 -0.2114 -0.2114 0.5543 0.5543 0.5551 0.5551 0.8795 0.8795 0.9230 0.9230 1.1375 1.1375 1.1414 1.1414 1.9934 1.9934 2.0098 2.0098 2.1475 2.1475 2.1476 2.1476 2.4067 2.4067 2.4244 2.4244 3.4155 3.4155 3.4200 3.4200 12.1251 12.1251 12.1262 12.1262 14.7758 14.7758 14.8063 14.8063 16.5098 16.5098 k = 0.3088 0.5000 0.7507 ( 2780 PWs) bands (ev): -17.4714 -17.4714 -17.4701 -17.4701 -17.3047 -17.3047 -17.3046 -17.3046 -1.6193 -1.6193 -1.6110 -1.6110 -1.0187 -1.0187 -0.9776 -0.9776 -0.5550 -0.5550 -0.5314 -0.5314 -0.2459 -0.2459 -0.2296 -0.2296 0.5562 0.5562 0.5562 0.5562 0.8847 0.8847 0.9242 0.9242 1.1524 1.1524 1.1563 1.1563 2.0388 2.0388 2.0567 2.0567 2.1592 2.1592 2.1622 2.1622 2.4020 2.4020 2.4186 2.4186 3.3844 3.3844 3.3885 3.3885 12.0977 12.0977 12.0984 12.0984 14.8257 14.8257 14.8561 14.8561 16.4654 16.4655 k = 0.3235 0.5000 0.7507 ( 2780 PWs) bands (ev): -17.4719 -17.4719 -17.4706 -17.4706 -17.3040 -17.3040 -17.3038 -17.3038 -1.6319 -1.6319 -1.6243 -1.6243 -1.0118 -1.0118 -0.9716 -0.9716 -0.5659 -0.5659 -0.5410 -0.5410 -0.2602 -0.2602 -0.2458 -0.2458 0.5571 0.5571 0.5578 0.5578 0.8894 0.8894 0.9251 0.9251 1.1666 1.1666 1.1704 1.1704 2.0827 2.0827 2.1035 2.1035 2.1714 2.1714 2.1787 2.1787 2.3970 2.3970 2.4124 2.4124 3.3522 3.3522 3.3559 3.3559 12.0715 12.0715 12.0720 12.0720 14.8762 14.8762 14.9065 14.9065 16.4229 16.4229 k = 0.3382 0.5000 0.7507 ( 2776 PWs) bands (ev): -17.4723 -17.4723 -17.4712 -17.4712 -17.3032 -17.3032 -17.3031 -17.3031 -1.6437 -1.6437 -1.6369 -1.6369 -1.0041 -1.0041 -0.9650 -0.9650 -0.5778 -0.5778 -0.5518 -0.5518 -0.2725 -0.2725 -0.2599 -0.2599 0.5580 0.5580 0.5591 0.5591 0.8936 0.8936 0.9257 0.9257 1.1800 1.1800 1.1837 1.1837 2.1230 2.1230 2.1487 2.1487 2.1855 2.1855 2.1988 2.1988 2.3919 2.3919 2.4058 2.4058 3.3191 3.3191 3.3225 3.3225 12.0469 12.0469 12.0471 12.0471 14.9270 14.9270 14.9573 14.9573 16.3819 16.3819 k = 0.3529 0.5000 0.7507 ( 2780 PWs) bands (ev): -17.4727 -17.4727 -17.4717 -17.4717 -17.3025 -17.3025 -17.3024 -17.3024 -1.6549 -1.6549 -1.6487 -1.6487 -0.9960 -0.9960 -0.9580 -0.9580 -0.5905 -0.5905 -0.5638 -0.5638 -0.2829 -0.2829 -0.2721 -0.2721 0.5587 0.5587 0.5602 0.5602 0.8974 0.8974 0.9260 0.9260 1.1926 1.1926 1.1961 1.1961 2.1563 2.1563 2.1833 2.1833 2.2101 2.2101 2.2255 2.2255 2.3867 2.3867 2.3990 2.3990 3.2851 3.2851 3.2882 3.2882 12.0239 12.0239 12.0239 12.0239 14.9780 14.9780 15.0081 15.0081 16.3424 16.3424 k = 0.3676 0.5000 0.7507 ( 2780 PWs) bands (ev): -17.4731 -17.4731 -17.4722 -17.4722 -17.3019 -17.3019 -17.3018 -17.3018 -1.6651 -1.6651 -1.6597 -1.6597 -0.9873 -0.9873 -0.9508 -0.9508 -0.6036 -0.6036 -0.5767 -0.5767 -0.2917 -0.2917 -0.2824 -0.2824 0.5593 0.5593 0.5611 0.5611 0.9008 0.9008 0.9262 0.9262 1.2042 1.2042 1.2074 1.2074 2.1811 2.1811 2.2003 2.2003 2.2515 2.2515 2.2596 2.2596 2.3817 2.3817 2.3920 2.3920 3.2507 3.2507 3.2534 3.2534 12.0026 12.0026 12.0027 12.0027 15.0288 15.0288 15.0586 15.0586 16.3040 16.3040 k = 0.3824 0.5000 0.7507 ( 2784 PWs) bands (ev): -17.4735 -17.4735 -17.4726 -17.4726 -17.3013 -17.3013 -17.3012 -17.3012 -1.6745 -1.6745 -1.6697 -1.6697 -0.9783 -0.9783 -0.9436 -0.9436 -0.6168 -0.6168 -0.5901 -0.5901 -0.2990 -0.2990 -0.2910 -0.2910 0.5600 0.5600 0.5618 0.5618 0.9038 0.9038 0.9260 0.9260 1.2147 1.2147 1.2177 1.2177 2.2000 2.2000 2.2132 2.2132 2.2958 2.2958 2.2969 2.2969 2.3782 2.3782 2.3852 2.3852 3.2160 3.2160 3.2184 3.2184 11.9832 11.9832 11.9833 11.9833 15.0790 15.0790 15.1083 15.1083 16.2668 16.2668 k = 0.3971 0.5000 0.7507 ( 2788 PWs) bands (ev): -17.4738 -17.4738 -17.4730 -17.4730 -17.3008 -17.3008 -17.3007 -17.3007 -1.6829 -1.6829 -1.6788 -1.6788 -0.9691 -0.9691 -0.9365 -0.9365 -0.6297 -0.6297 -0.6038 -0.6038 -0.3049 -0.3049 -0.2983 -0.2983 0.5605 0.5605 0.5624 0.5624 0.9066 0.9066 0.9257 0.9257 1.2241 1.2241 1.2268 1.2268 2.2160 2.2160 2.2251 2.2251 2.3291 2.3291 2.3369 2.3369 2.3805 2.3805 2.3809 2.3809 3.1814 3.1814 3.1835 3.1835 11.9658 11.9658 11.9660 11.9660 15.1281 15.1281 15.1567 15.1567 16.2307 16.2307 k = 0.4118 0.5000 0.7507 ( 2792 PWs) bands (ev): -17.4740 -17.4740 -17.4734 -17.4734 -17.3003 -17.3003 -17.3003 -17.3003 -1.6903 -1.6903 -1.6868 -1.6868 -0.9597 -0.9597 -0.9298 -0.9298 -0.6420 -0.6420 -0.6175 -0.6175 -0.3097 -0.3097 -0.3041 -0.3041 0.5610 0.5610 0.5628 0.5628 0.9091 0.9091 0.9254 0.9254 1.2324 1.2324 1.2348 1.2348 2.2304 2.2304 2.2367 2.2367 2.3422 2.3422 2.3575 2.3575 2.3944 2.3944 2.4020 2.4020 3.1475 3.1475 3.1492 3.1492 11.9506 11.9506 11.9509 11.9509 15.1755 15.1755 15.2028 15.2028 16.1962 16.1962 k = 0.4265 0.5000 0.7507 ( 2788 PWs) bands (ev): -17.4742 -17.4742 -17.4737 -17.4737 -17.3000 -17.3000 -17.2999 -17.2999 -1.6966 -1.6966 -1.6937 -1.6937 -0.9505 -0.9505 -0.9238 -0.9238 -0.6529 -0.6529 -0.6306 -0.6306 -0.3133 -0.3133 -0.3089 -0.3089 0.5615 0.5615 0.5631 0.5631 0.9115 0.9115 0.9248 0.9248 1.2396 1.2396 1.2416 1.2416 2.2440 2.2440 2.2480 2.2480 2.3404 2.3404 2.3534 2.3534 2.4301 2.4301 2.4354 2.4354 3.1149 3.1149 3.1163 3.1163 11.9376 11.9376 11.9379 11.9379 15.2202 15.2202 15.2457 15.2457 16.1637 16.1637 k = 0.4412 0.5000 0.7507 ( 2788 PWs) bands (ev): -17.4744 -17.4744 -17.4740 -17.4740 -17.2996 -17.2996 -17.2996 -17.2996 -1.7017 -1.7017 -1.6994 -1.6994 -0.9416 -0.9416 -0.9188 -0.9188 -0.6622 -0.6622 -0.6428 -0.6428 -0.3161 -0.3161 -0.3126 -0.3126 0.5620 0.5620 0.5633 0.5633 0.9135 0.9135 0.9242 0.9242 1.2455 1.2455 1.2471 1.2471 2.2569 2.2569 2.2590 2.2590 2.3345 2.3345 2.3451 2.3451 2.4659 2.4659 2.4694 2.4694 3.0846 3.0846 3.0857 3.0857 11.9269 11.9269 11.9271 11.9271 15.2611 15.2611 15.2839 15.2839 16.1347 16.1347 k = 0.4559 0.5000 0.7507 ( 2784 PWs) bands (ev): -17.4745 -17.4745 -17.4742 -17.4742 -17.2994 -17.2994 -17.2993 -17.2993 -1.7057 -1.7057 -1.7039 -1.7039 -0.9333 -0.9333 -0.9152 -0.9152 -0.6693 -0.6693 -0.6536 -0.6536 -0.3181 -0.3181 -0.3155 -0.3155 0.5623 0.5623 0.5634 0.5634 0.9155 0.9155 0.9234 0.9234 1.2502 1.2502 1.2514 1.2514 2.2694 2.2694 2.2698 2.2698 2.3270 2.3270 2.3358 2.3358 2.4974 2.4974 2.4997 2.4997 3.0581 3.0581 3.0589 3.0589 11.9185 11.9185 11.9187 11.9187 15.2968 15.2968 15.3156 15.3156 16.1106 16.1106 k = 0.4706 0.5000 0.7507 ( 2776 PWs) bands (ev): -17.4746 -17.4746 -17.4744 -17.4744 -17.2992 -17.2992 -17.2991 -17.2991 -1.7084 -1.7084 -1.7073 -1.7073 -0.9260 -0.9260 -0.9134 -0.9134 -0.6737 -0.6737 -0.6626 -0.6626 -0.3193 -0.3193 -0.3176 -0.3176 0.5627 0.5627 0.5634 0.5634 0.9172 0.9172 0.9225 0.9225 1.2537 1.2537 1.2545 1.2545 2.2802 2.2802 2.2814 2.2814 2.3188 2.3188 2.3259 2.3259 2.5222 2.5222 2.5236 2.5236 3.0371 3.0371 3.0376 3.0376 11.9125 11.9125 11.9126 11.9126 15.3255 15.3255 15.3391 15.3391 16.0934 16.0934 k = 0.4853 0.5000 0.7507 ( 2776 PWs) bands (ev): -17.4746 -17.4746 -17.4745 -17.4745 -17.2990 -17.2990 -17.2990 -17.2990 -1.7100 -1.7100 -1.7094 -1.7094 -0.9201 -0.9201 -0.9136 -0.9136 -0.6752 -0.6752 -0.6695 -0.6695 -0.3198 -0.3198 -0.3190 -0.3190 0.5629 0.5629 0.5633 0.5633 0.9188 0.9188 0.9214 0.9214 1.2558 1.2558 1.2562 1.2562 2.2903 2.2903 2.2929 2.2929 2.3100 2.3100 2.3156 2.3156 2.5384 2.5384 2.5390 2.5390 3.0234 3.0234 3.0237 3.0237 11.9089 11.9089 11.9090 11.9090 15.3453 15.3453 15.3525 15.3525 16.0848 16.0848 k = 0.5000 0.5000 0.7507 ( 2784 PWs) bands (ev): -17.4746 -17.4746 -17.4746 -17.4746 -17.2990 -17.2990 -17.2990 -17.2990 -1.7103 -1.7103 -1.7103 -1.7103 -0.9159 -0.9159 -0.9159 -0.9159 -0.6739 -0.6739 -0.6739 -0.6739 -0.3197 -0.3197 -0.3197 -0.3197 0.5631 0.5631 0.5631 0.5631 0.9201 0.9201 0.9201 0.9201 1.2566 1.2566 1.2566 1.2566 2.2993 2.2993 2.2993 2.2993 2.3055 2.3055 2.3055 2.3055 2.5442 2.5442 2.5442 2.5442 3.0187 3.0187 3.0187 3.0187 11.9077 11.9077 11.9077 11.9077 15.3546 15.3546 15.3546 15.3546 16.0862 16.0862 k = 0.5000 0.5000 0.7507 ( 2784 PWs) bands (ev): -17.4746 -17.4746 -17.4746 -17.4746 -17.2990 -17.2990 -17.2990 -17.2990 -1.7103 -1.7103 -1.7103 -1.7103 -0.9159 -0.9159 -0.9159 -0.9159 -0.6739 -0.6739 -0.6739 -0.6739 -0.3197 -0.3197 -0.3197 -0.3197 0.5631 0.5631 0.5631 0.5631 0.9201 0.9201 0.9201 0.9201 1.2566 1.2566 1.2566 1.2566 2.2993 2.2993 2.2993 2.2993 2.3055 2.3055 2.3055 2.3055 2.5442 2.5442 2.5442 2.5442 3.0187 3.0187 3.0187 3.0187 11.9077 11.9077 11.9077 11.9077 15.3546 15.3546 15.3546 15.3546 16.0862 16.0862 k = 0.4896 0.4896 0.7507 ( 2776 PWs) bands (ev): -17.4746 -17.4746 -17.4745 -17.4745 -17.2991 -17.2991 -17.2990 -17.2990 -1.7102 -1.7102 -1.7092 -1.7092 -0.9204 -0.9204 -0.9133 -0.9133 -0.6759 -0.6759 -0.6688 -0.6688 -0.3199 -0.3199 -0.3188 -0.3188 0.5629 0.5629 0.5634 0.5634 0.9188 0.9188 0.9214 0.9214 1.2555 1.2555 1.2565 1.2565 2.2873 2.2873 2.3008 2.3008 2.3030 2.3030 2.3177 2.3177 2.5332 2.5332 2.5443 2.5443 3.0184 3.0184 3.0285 3.0285 11.9081 11.9081 11.9098 11.9098 15.3405 15.3405 15.3574 15.3574 16.0799 16.0799 k = 0.4792 0.4792 0.7507 ( 2780 PWs) bands (ev): -17.4748 -17.4748 -17.4742 -17.4742 -17.2995 -17.2995 -17.2988 -17.2988 -1.7096 -1.7096 -1.7061 -1.7061 -0.9278 -0.9278 -0.9113 -0.9113 -0.6783 -0.6783 -0.6583 -0.6583 -0.3200 -0.3200 -0.3169 -0.3169 0.5623 0.5623 0.5638 0.5638 0.9172 0.9172 0.9225 0.9225 1.2523 1.2523 1.2557 1.2557 2.2725 2.2725 2.2996 2.2996 2.3027 2.3027 2.3316 2.3316 2.5028 2.5028 2.5445 2.5445 3.0176 3.0176 3.0555 3.0555 11.9091 11.9091 11.9161 11.9161 15.3035 15.3035 15.3633 15.3633 16.0673 16.0673 k = 0.4688 0.4687 0.7507 ( 2780 PWs) bands (ev): -17.4750 -17.4750 -17.4737 -17.4737 -17.3000 -17.3000 -17.2987 -17.2987 -1.7086 -1.7086 -1.7009 -1.7009 -0.9380 -0.9380 -0.9092 -0.9092 -0.6816 -0.6816 -0.6423 -0.6423 -0.3201 -0.3201 -0.3136 -0.3136 0.5613 0.5613 0.5644 0.5644 0.9154 0.9154 0.9235 0.9235 1.2471 1.2471 1.2545 1.2545 2.2572 2.2572 2.2973 2.2973 2.3025 2.3025 2.3452 2.3452 2.4584 2.4584 2.5448 2.5448 3.0163 3.0163 3.0945 3.0945 11.9107 11.9107 11.9266 11.9266 15.2488 15.2488 15.3731 15.3731 16.0487 16.0487 k = 0.4583 0.4583 0.7507 ( 2784 PWs) bands (ev): -17.4753 -17.4753 -17.4731 -17.4731 -17.3008 -17.3008 -17.2984 -17.2984 -1.7072 -1.7072 -1.6937 -1.6937 -0.9504 -0.9504 -0.9065 -0.9065 -0.6860 -0.6860 -0.6216 -0.6216 -0.3203 -0.3203 -0.3091 -0.3091 0.5600 0.5600 0.5653 0.5653 0.9134 0.9134 0.9243 0.9243 1.2397 1.2397 1.2529 1.2529 2.2418 2.2418 2.2936 2.2936 2.3020 2.3020 2.3583 2.3583 2.4053 2.4053 2.5453 2.5453 3.0145 3.0145 3.1405 3.1405 11.9130 11.9130 11.9411 11.9411 15.1825 15.1825 15.3868 15.3868 16.0257 16.0257 k = 0.4479 0.4479 0.7507 ( 2784 PWs) bands (ev): -17.4758 -17.4758 -17.4722 -17.4722 -17.3017 -17.3017 -17.2980 -17.2980 -1.7054 -1.7054 -1.6844 -1.6844 -0.9641 -0.9641 -0.9032 -0.9032 -0.6915 -0.6915 -0.5971 -0.5971 -0.3205 -0.3205 -0.3034 -0.3034 0.5583 0.5583 0.5664 0.5664 0.9112 0.9112 0.9250 0.9250 1.2302 1.2302 1.2507 1.2507 2.2262 2.2262 2.2869 2.2869 2.3010 2.3010 2.3494 2.3494 2.3710 2.3710 2.5458 2.5458 3.0121 3.0121 3.1899 3.1899 11.9158 11.9158 11.9597 11.9597 15.1091 15.1091 15.4043 15.4043 16.0001 16.0001 k = 0.4375 0.4375 0.7507 ( 2786 PWs) bands (ev): -17.4763 -17.4763 -17.4713 -17.4713 -17.3029 -17.3029 -17.2976 -17.2976 -1.7031 -1.7031 -1.6733 -1.6733 -0.9784 -0.9784 -0.8993 -0.8993 -0.6982 -0.6982 -0.5697 -0.5697 -0.3206 -0.3206 -0.2966 -0.2966 0.5561 0.5561 0.5676 0.5676 0.9086 0.9086 0.9257 0.9257 1.2188 1.2188 1.2480 1.2480 2.2104 2.2104 2.2625 2.2625 2.2963 2.2963 2.3112 2.3112 2.3831 2.3831 2.5464 2.5464 3.0091 3.0091 3.2407 3.2407 11.9193 11.9193 11.9821 11.9821 15.0316 15.0316 15.4256 15.4256 15.9731 15.9731 k = 0.4271 0.4271 0.7507 ( 2784 PWs) bands (ev): -17.4768 -17.4768 -17.4702 -17.4702 -17.3042 -17.3042 -17.2971 -17.2971 -1.7002 -1.7002 -1.6603 -1.6603 -0.9929 -0.9929 -0.8947 -0.8947 -0.7057 -0.7057 -0.5397 -0.5397 -0.3209 -0.3209 -0.2889 -0.2889 0.5537 0.5537 0.5692 0.5692 0.9058 0.9058 0.9263 0.9263 1.2055 1.2055 1.2447 1.2447 2.1929 2.1929 2.2079 2.2079 2.2883 2.2883 2.3054 2.3054 2.3946 2.3946 2.5471 2.5471 3.0056 3.0056 3.2913 3.2913 11.9233 11.9233 12.0083 12.0083 14.9520 14.9520 15.4507 15.4507 15.9455 15.9455 k = 0.4167 0.4167 0.7507 ( 2784 PWs) bands (ev): -17.4775 -17.4775 -17.4689 -17.4689 -17.3056 -17.3056 -17.2966 -17.2966 -1.6969 -1.6969 -1.6454 -1.6454 -1.0074 -1.0074 -0.8894 -0.8894 -0.7141 -0.7141 -0.5078 -0.5078 -0.3210 -0.3210 -0.2803 -0.2803 0.5509 0.5509 0.5708 0.5708 0.9025 0.9025 0.9267 0.9267 1.1902 1.1902 1.2409 1.2409 2.1399 2.1399 2.1809 2.1809 2.2819 2.2819 2.3047 2.3047 2.4056 2.4056 2.5479 2.5479 3.0015 3.0015 3.3409 3.3409 11.9278 11.9278 12.0380 12.0380 14.8718 14.8718 15.4796 15.4796 15.9180 15.9180 k = 0.4062 0.4062 0.7507 ( 2784 PWs) bands (ev): -17.4783 -17.4783 -17.4677 -17.4677 -17.3072 -17.3072 -17.2959 -17.2959 -1.6929 -1.6929 -1.6289 -1.6289 -1.0217 -1.0217 -0.8835 -0.8835 -0.7234 -0.7234 -0.4740 -0.4740 -0.3211 -0.3211 -0.2710 -0.2710 0.5477 0.5477 0.5726 0.5726 0.8987 0.8987 0.9271 0.9271 1.1732 1.1732 1.2365 1.2365 2.0743 2.0743 2.1654 2.1654 2.2757 2.2757 2.3047 2.3047 2.4159 2.4159 2.5487 2.5487 2.9968 2.9968 3.3886 3.3886 11.9327 11.9327 12.0710 12.0710 14.7919 14.7919 15.5120 15.5120 15.8909 15.8909 k = 0.3958 0.3958 0.7507 ( 2784 PWs) bands (ev): -17.4791 -17.4791 -17.4663 -17.4663 -17.3088 -17.3088 -17.2952 -17.2952 -1.6883 -1.6883 -1.6107 -1.6107 -1.0355 -1.0355 -0.8770 -0.8770 -0.7334 -0.7334 -0.4389 -0.4389 -0.3211 -0.3211 -0.2610 -0.2610 0.5442 0.5442 0.5745 0.5745 0.8943 0.8943 0.9274 0.9274 1.1544 1.1544 1.2316 1.2316 2.0085 2.0085 2.1504 2.1504 2.2692 2.2692 2.3051 2.3051 2.4255 2.4255 2.5494 2.5494 2.9915 2.9915 3.4341 3.4341 11.9381 11.9381 12.1070 12.1070 14.7131 14.7131 15.5481 15.5481 15.8646 15.8646 k = 0.3854 0.3854 0.7507 ( 2792 PWs) bands (ev): -17.4800 -17.4800 -17.4650 -17.4650 -17.3104 -17.3104 -17.2945 -17.2945 -1.6831 -1.6831 -1.5910 -1.5910 -1.0488 -1.0488 -0.8699 -0.8699 -0.7440 -0.7440 -0.4029 -0.4029 -0.3205 -0.3205 -0.2504 -0.2504 0.5403 0.5403 0.5764 0.5764 0.8890 0.8890 0.9276 0.9276 1.1343 1.1343 1.2260 1.2260 1.9435 1.9435 2.1359 2.1359 2.2624 2.2624 2.3058 2.3058 2.4344 2.4344 2.5502 2.5502 2.9856 2.9856 3.4769 3.4769 11.9438 11.9438 12.1458 12.1458 14.6361 14.6361 15.5876 15.5876 15.8392 15.8392 k = 0.3750 0.3750 0.7507 ( 2792 PWs) bands (ev): -17.4810 -17.4810 -17.4636 -17.4636 -17.3121 -17.3121 -17.2937 -17.2937 -1.6771 -1.6771 -1.5700 -1.5700 -1.0616 -1.0616 -0.8623 -0.8623 -0.7551 -0.7551 -0.3674 -0.3674 -0.3181 -0.3181 -0.2394 -0.2394 0.5361 0.5361 0.5784 0.5784 0.8829 0.8829 0.9276 0.9276 1.1129 1.1129 1.2199 1.2199 1.8801 1.8801 2.1219 2.1219 2.2554 2.2554 2.3068 2.3068 2.4427 2.4427 2.5510 2.5510 2.9790 2.9790 3.5166 3.5166 11.9498 11.9498 12.1868 12.1868 14.5615 14.5615 15.6305 15.6305 15.8150 15.8150 k = 0.3646 0.3646 0.7507 ( 2796 PWs) bands (ev): -17.4820 -17.4820 -17.4623 -17.4623 -17.3136 -17.3136 -17.2928 -17.2928 -1.6704 -1.6704 -1.5476 -1.5476 -1.0738 -1.0738 -0.8546 -0.8546 -0.7664 -0.7664 -0.3399 -0.3399 -0.3069 -0.3069 -0.2280 -0.2280 0.5315 0.5315 0.5803 0.5803 0.8755 0.8755 0.9276 0.9276 1.0906 1.0906 1.2130 1.2130 1.8186 1.8186 2.1084 2.1084 2.2481 2.2481 2.3080 2.3080 2.4503 2.4503 2.5517 2.5517 2.9717 2.9717 3.5531 3.5531 11.9560 11.9560 12.2295 12.2295 14.4901 14.4901 15.6765 15.6765 15.7922 15.7922 k = 0.3542 0.3542 0.7507 ( 2796 PWs) bands (ev): -17.4831 -17.4831 -17.4612 -17.4612 -17.3151 -17.3151 -17.2919 -17.2919 -1.6629 -1.6629 -1.5242 -1.5242 -1.0855 -1.0855 -0.8470 -0.8470 -0.7774 -0.7774 -0.3311 -0.3311 -0.2760 -0.2760 -0.2161 -0.2161 0.5266 0.5266 0.5821 0.5821 0.8666 0.8666 0.9274 0.9274 1.0678 1.0678 1.2057 1.2057 1.7597 1.7597 2.0956 2.0956 2.2405 2.2405 2.3095 2.3095 2.4572 2.4572 2.5524 2.5524 2.9638 2.9638 3.5862 3.5862 11.9624 11.9624 12.2735 12.2735 14.4225 14.4225 15.7245 15.7245 15.7719 15.7719 k = 0.3438 0.3437 0.7507 ( 2792 PWs) bands (ev): -17.4843 -17.4843 -17.4601 -17.4601 -17.3165 -17.3165 -17.2909 -17.2909 -1.6545 -1.6545 -1.4998 -1.4998 -1.0965 -1.0965 -0.8407 -0.8407 -0.7871 -0.7871 -0.3294 -0.3294 -0.2381 -0.2381 -0.2033 -0.2033 0.5215 0.5215 0.5838 0.5838 0.8557 0.8557 0.9270 0.9270 1.0452 1.0452 1.1978 1.1978 1.7039 1.7039 2.0835 2.0835 2.2328 2.2328 2.3113 2.3113 2.4633 2.4633 2.5530 2.5530 2.9553 2.9553 3.6157 3.6157 11.9690 11.9690 12.3178 12.3178 14.3594 14.3594 15.7450 15.7450 15.7836 15.7836 k = 0.3333 0.3333 0.7507 ( 2792 PWs) bands (ev): -17.4855 -17.4855 -17.4593 -17.4593 -17.3176 -17.3176 -17.2899 -17.2899 -1.6453 -1.6453 -1.4745 -1.4745 -1.1070 -1.1070 -0.8382 -0.8382 -0.7929 -0.7929 -0.3291 -0.3291 -0.2047 -0.2047 -0.1839 -0.1839 0.5160 0.5160 0.5851 0.5851 0.8422 0.8422 0.9263 0.9263 1.0234 1.0234 1.1892 1.1892 1.6515 1.6515 2.0721 2.0721 2.2249 2.2249 2.3134 2.3134 2.4688 2.4688 2.5536 2.5536 2.9460 2.9460 3.6415 3.6415 11.9756 11.9756 12.3618 12.3618 14.3018 14.3018 15.7281 15.7281 15.8371 15.8371 k = 0.3229 0.3229 0.7507 ( 2796 PWs) bands (ev): -17.4868 -17.4868 -17.4588 -17.4588 -17.3185 -17.3185 -17.2888 -17.2888 -1.6351 -1.6351 -1.4486 -1.4486 -1.1169 -1.1169 -0.8426 -0.8426 -0.7918 -0.7918 -0.3293 -0.3293 -0.1879 -0.1879 -0.1471 -0.1471 0.5103 0.5103 0.5860 0.5860 0.8258 0.8258 0.9252 0.9252 1.0032 1.0032 1.1802 1.1802 1.6029 1.6029 2.0616 2.0616 2.2169 2.2169 2.3158 2.3158 2.4735 2.4735 2.5541 2.5541 2.9361 2.9361 3.6633 3.6633 11.9823 11.9823 12.4045 12.4045 14.2506 14.2506 15.7107 15.7107 15.8954 15.8954 k = 0.3125 0.3125 0.7507 ( 2792 PWs) bands (ev): -17.4881 -17.4881 -17.4585 -17.4585 -17.3190 -17.3190 -17.2877 -17.2877 -1.6240 -1.6240 -1.4221 -1.4221 -1.1263 -1.1263 -0.8527 -0.8527 -0.7848 -0.7848 -0.3297 -0.3297 -0.1766 -0.1766 -0.1045 -0.1045 0.5043 0.5043 0.5864 0.5864 0.8059 0.8059 0.9234 0.9234 0.9855 0.9855 1.1707 1.1707 1.5587 1.5587 2.0519 2.0519 2.2089 2.2089 2.3185 2.3185 2.4776 2.4776 2.5545 2.5545 2.9255 2.9255 3.6812 3.6812 11.9889 11.9889 12.4448 12.4448 14.2068 14.2068 15.6944 15.6944 15.9568 15.9568 k = 0.3021 0.3021 0.7507 ( 2788 PWs) bands (ev): -17.4894 -17.4894 -17.4585 -17.4585 -17.3193 -17.3193 -17.2866 -17.2866 -1.6119 -1.6119 -1.3953 -1.3953 -1.1351 -1.1351 -0.8659 -0.8659 -0.7745 -0.7745 -0.3302 -0.3302 -0.1671 -0.1671 -0.0605 -0.0605 0.4981 0.4981 0.5860 0.5860 0.7826 0.7826 0.9207 0.9207 0.9710 0.9710 1.1609 1.1609 1.5192 1.5192 2.0431 2.0431 2.2008 2.2008 2.3215 2.3215 2.4809 2.4809 2.5548 2.5548 2.9142 2.9142 3.6950 3.6950 11.9954 11.9954 12.4814 12.4814 14.1716 14.1716 15.6795 15.6795 16.0210 16.0210 k = 0.2917 0.2917 0.7507 ( 2788 PWs) bands (ev): -17.4908 -17.4908 -17.4590 -17.4590 -17.3192 -17.3192 -17.2855 -17.2855 -1.5989 -1.5989 -1.3683 -1.3683 -1.1433 -1.1433 -0.8808 -0.8808 -0.7626 -0.7626 -0.3308 -0.3308 -0.1589 -0.1589 -0.0158 -0.0158 0.4916 0.4916 0.5847 0.5847 0.7560 0.7560 0.9168 0.9168 0.9601 0.9601 1.1508 1.1508 1.4847 1.4847 2.0353 2.0353 2.1927 2.1927 2.3247 2.3247 2.4836 2.4836 2.5550 2.5550 2.9022 2.9022 3.7048 3.7048 12.0018 12.0018 12.5132 12.5132 14.1461 14.1461 15.6660 15.6660 16.0879 16.0879 k = 0.2812 0.2812 0.7507 ( 2784 PWs) bands (ev): -17.4921 -17.4921 -17.4597 -17.4597 -17.3187 -17.3187 -17.2843 -17.2843 -1.5848 -1.5848 -1.3413 -1.3413 -1.1510 -1.1510 -0.8967 -0.8967 -0.7495 -0.7495 -0.3314 -0.3314 -0.1522 -0.1522 0.0292 0.0292 0.4850 0.4850 0.5822 0.5822 0.7269 0.7269 0.9118 0.9118 0.9527 0.9527 1.1404 1.1404 1.4554 1.4554 2.0284 2.0284 2.1847 2.1847 2.3282 2.3282 2.4856 2.4856 2.5551 2.5551 2.8896 2.8896 3.7103 3.7103 12.0081 12.0081 12.5390 12.5390 14.1314 14.1314 15.6539 15.6539 16.1572 16.1572 k = 0.2708 0.2708 0.7507 ( 2784 PWs) bands (ev): -17.4935 -17.4935 -17.4609 -17.4609 -17.3178 -17.3178 -17.2831 -17.2831 -1.5697 -1.5697 -1.3144 -1.3144 -1.1582 -1.1582 -0.9134 -0.9134 -0.7355 -0.7355 -0.3321 -0.3321 -0.1471 -0.1471 0.0744 0.0744 0.4782 0.4782 0.5776 0.5776 0.6964 0.6964 0.9061 0.9061 0.9481 0.9481 1.1300 1.1300 1.4317 1.4317 2.0225 2.0225 2.1768 2.1768 2.3319 2.3319 2.4870 2.4870 2.5550 2.5550 2.8763 2.8763 3.7117 3.7117 12.0142 12.0142 12.5578 12.5578 14.1284 14.1284 15.6433 15.6433 16.2288 16.2288 k = 0.2604 0.2604 0.7507 ( 2788 PWs) bands (ev): -17.4950 -17.4950 -17.4624 -17.4624 -17.3165 -17.3165 -17.2819 -17.2819 -1.5537 -1.5537 -1.2878 -1.2878 -1.1649 -1.1649 -0.9306 -0.9306 -0.7209 -0.7209 -0.3328 -0.3328 -0.1440 -0.1440 0.1196 0.1196 0.4710 0.4710 0.5697 0.5697 0.6663 0.6663 0.9007 0.9007 0.9453 0.9453 1.1195 1.1195 1.4135 1.4135 2.0176 2.0176 2.1690 2.1690 2.3358 2.3358 2.4877 2.4877 2.5549 2.5549 2.8624 2.8624 3.7089 3.7089 12.0201 12.0201 12.5691 12.5691 14.1376 14.1376 15.6341 15.6341 16.3025 16.3025 k = 0.2500 0.2500 0.7507 ( 2784 PWs) bands (ev): -17.4964 -17.4964 -17.4642 -17.4642 -17.3149 -17.3149 -17.2807 -17.2807 -1.5366 -1.5366 -1.2615 -1.2615 -1.1710 -1.1710 -0.9484 -0.9484 -0.7056 -0.7056 -0.3335 -0.3335 -0.1429 -0.1429 0.1643 0.1643 0.4634 0.4634 0.5566 0.5566 0.6395 0.6395 0.8960 0.8960 0.9436 0.9436 1.1092 1.1092 1.4013 1.4013 2.0136 2.0136 2.1613 2.1613 2.3398 2.3398 2.4879 2.4879 2.5546 2.5546 2.8478 2.8478 3.7019 3.7019 12.0257 12.0257 12.5727 12.5727 14.1590 14.1590 15.6264 15.6264 16.3784 16.3784 k = 0.2396 0.2396 0.7507 ( 2796 PWs) bands (ev): -17.4978 -17.4978 -17.4664 -17.4664 -17.3130 -17.3130 -17.2795 -17.2795 -1.5186 -1.5186 -1.2360 -1.2360 -1.1765 -1.1765 -0.9666 -0.9666 -0.6899 -0.6899 -0.3342 -0.3342 -0.1439 -0.1439 0.2081 0.2081 0.4544 0.4544 0.5368 0.5368 0.6187 0.6187 0.8923 0.8923 0.9425 0.9425 1.0990 1.0990 1.3948 1.3948 2.0106 2.0106 2.1538 2.1538 2.3440 2.3440 2.4874 2.4874 2.5543 2.5543 2.8327 2.8327 3.6908 3.6908 12.0310 12.0310 12.5686 12.5686 14.1923 14.1923 15.6202 15.6202 16.4560 16.4560 k = 0.2292 0.2292 0.7507 ( 2792 PWs) bands (ev): -17.4992 -17.4992 -17.4688 -17.4688 -17.3107 -17.3107 -17.2783 -17.2783 -1.4996 -1.4996 -1.2116 -1.2116 -1.1808 -1.1808 -0.9851 -0.9851 -0.6736 -0.6736 -0.3349 -0.3349 -0.1471 -0.1471 0.2501 0.2501 0.4429 0.4429 0.5130 0.5130 0.6041 0.6041 0.8898 0.8898 0.9419 0.9419 1.0892 1.0892 1.3944 1.3944 2.0085 2.0085 2.1466 2.1466 2.3484 2.3484 2.4865 2.4865 2.5538 2.5538 2.8170 2.8170 3.6756 3.6756 12.0361 12.0361 12.5577 12.5577 14.2367 14.2367 15.6155 15.6155 16.5355 16.5355 k = 0.2188 0.2187 0.7507 ( 2802 PWs) bands (ev): -17.5006 -17.5006 -17.4715 -17.4715 -17.3083 -17.3083 -17.2772 -17.2772 -1.4799 -1.4799 -1.1929 -1.1929 -1.1796 -1.1796 -1.0038 -1.0038 -0.6569 -0.6569 -0.3357 -0.3357 -0.1523 -0.1523 0.2885 0.2885 0.4256 0.4256 0.4923 0.4923 0.5930 0.5930 0.8884 0.8884 0.9417 0.9417 1.0797 1.0797 1.3999 1.3999 2.0073 2.0073 2.1395 2.1395 2.3527 2.3527 2.4849 2.4849 2.5533 2.5533 2.8009 2.8009 3.6563 3.6563 12.0408 12.0408 12.5407 12.5407 14.2910 14.2910 15.6121 15.6121 16.6164 16.6164 k = 0.2083 0.2083 0.7507 ( 2802 PWs) bands (ev): -17.5020 -17.5020 -17.4744 -17.4744 -17.3056 -17.3056 -17.2760 -17.2760 -1.4594 -1.4594 -1.1920 -1.1920 -1.1606 -1.1606 -1.0226 -1.0226 -0.6399 -0.6399 -0.3364 -0.3364 -0.1595 -0.1595 0.3178 0.3178 0.4036 0.4036 0.4815 0.4815 0.5839 0.5839 0.8880 0.8880 0.9417 0.9417 1.0706 1.0706 1.4114 1.4114 2.0069 2.0069 2.1327 2.1327 2.3572 2.3572 2.4829 2.4829 2.5528 2.5528 2.7843 2.7843 3.6330 3.6330 12.0453 12.0453 12.5188 12.5188 14.3542 14.3542 15.6102 15.6102 16.6983 16.6983 k = 0.1979 0.1979 0.7507 ( 2810 PWs) bands (ev): -17.5034 -17.5034 -17.4774 -17.4774 -17.3027 -17.3027 -17.2749 -17.2749 -1.4383 -1.4383 -1.1943 -1.1943 -1.1387 -1.1387 -1.0414 -1.0414 -0.6225 -0.6225 -0.3371 -0.3371 -0.1684 -0.1684 0.3210 0.3210 0.3928 0.3928 0.4820 0.4820 0.5758 0.5758 0.8882 0.8882 0.9417 0.9417 1.0620 1.0620 1.4288 1.4288 2.0073 2.0073 2.1261 2.1261 2.3616 2.3616 2.4804 2.4804 2.5521 2.5521 2.7673 2.7673 3.6058 3.6058 12.0494 12.0494 12.4929 12.4929 14.4247 14.4247 15.6097 15.6097 16.7378 16.7378 k = 0.1875 0.1875 0.7507 ( 2810 PWs) bands (ev): -17.5047 -17.5047 -17.4805 -17.4805 -17.2997 -17.2997 -17.2737 -17.2737 -1.4169 -1.4169 -1.1960 -1.1960 -1.1177 -1.1177 -1.0596 -1.0596 -0.6050 -0.6050 -0.3378 -0.3378 -0.1787 -0.1787 0.2926 0.2926 0.3984 0.3984 0.4938 0.4938 0.5696 0.5696 0.8891 0.8891 0.9421 0.9421 1.0542 1.0542 1.4521 1.4521 2.0084 2.0084 2.1199 2.1199 2.3661 2.3661 2.4774 2.4774 2.5515 2.5515 2.7501 2.7501 3.5748 3.5748 12.0533 12.0533 12.4642 12.4642 14.5014 14.5014 15.6105 15.6105 16.7544 16.7544 k = 0.1771 0.1771 0.7507 ( 2802 PWs) bands (ev): -17.5060 -17.5060 -17.4837 -17.4837 -17.2966 -17.2966 -17.2726 -17.2726 -1.3954 -1.3954 -1.1967 -1.1967 -1.0996 -1.0996 -1.0756 -1.0756 -0.5872 -0.5872 -0.3385 -0.3385 -0.1901 -0.1901 0.2525 0.2525 0.4024 0.4024 0.5105 0.5105 0.5696 0.5696 0.8905 0.8905 0.9426 0.9426 1.0470 1.0470 1.4811 1.4811 2.0102 2.0102 2.1140 2.1140 2.3705 2.3705 2.4739 2.4739 2.5508 2.5508 2.7326 2.7326 3.5402 3.5402 12.0568 12.0568 12.4335 12.4335 14.5830 14.5830 15.6127 15.6127 16.7712 16.7712 k = 0.1667 0.1667 0.7507 ( 2798 PWs) bands (ev): -17.5073 -17.5073 -17.4869 -17.4869 -17.2935 -17.2935 -17.2716 -17.2716 -1.3743 -1.3743 -1.1959 -1.1959 -1.1012 -1.1012 -1.0725 -1.0725 -0.5694 -0.5694 -0.3392 -0.3392 -0.2024 -0.2024 0.2086 0.2086 0.4022 0.4022 0.5177 0.5177 0.5849 0.5849 0.8921 0.8921 0.9432 0.9432 1.0405 1.0405 1.5154 1.5154 2.0126 2.0126 2.1084 2.1084 2.3749 2.3749 2.4701 2.4701 2.5501 2.5501 2.7150 2.7150 3.5019 3.5019 12.0601 12.0601 12.4017 12.4017 14.6685 14.6685 15.6161 15.6161 16.7881 16.7881 k = 0.1562 0.1562 0.7507 ( 2798 PWs) bands (ev): -17.5085 -17.5085 -17.4900 -17.4900 -17.2904 -17.2904 -17.2705 -17.2705 -1.3542 -1.3542 -1.1932 -1.1932 -1.1170 -1.1170 -1.0556 -1.0556 -0.5515 -0.5515 -0.3398 -0.3398 -0.2153 -0.2153 0.1631 0.1631 0.3998 0.3998 0.5129 0.5129 0.6140 0.6140 0.8937 0.8937 0.9440 0.9440 1.0347 1.0347 1.5549 1.5549 2.0156 2.0156 2.1031 2.1031 2.3791 2.3791 2.4659 2.4659 2.5494 2.5494 2.6974 2.6974 3.4601 3.4601 12.0630 12.0630 12.3695 12.3695 14.7567 14.7567 15.6207 15.6207 16.8052 16.8052 k = 0.1458 0.1458 0.7507 ( 2798 PWs) bands (ev): -17.5096 -17.5096 -17.4932 -17.4932 -17.2873 -17.2873 -17.2696 -17.2696 -1.3360 -1.3360 -1.1886 -1.1886 -1.1327 -1.1327 -1.0384 -1.0384 -0.5337 -0.5337 -0.3405 -0.3405 -0.2283 -0.2283 0.1168 0.1168 0.3962 0.3962 0.5030 0.5030 0.6481 0.6481 0.8952 0.8952 0.9449 0.9449 1.0296 1.0296 1.5990 1.5990 2.0190 2.0190 2.0982 2.0982 2.3833 2.3833 2.4614 2.4614 2.5486 2.5486 2.6799 2.6799 3.4150 3.4150 12.0657 12.0657 12.3374 12.3374 14.8466 14.8466 15.6263 15.6263 16.8224 16.8224 k = 0.1354 0.1354 0.7507 ( 2802 PWs) bands (ev): -17.5107 -17.5107 -17.4962 -17.4962 -17.2843 -17.2843 -17.2686 -17.2686 -1.3205 -1.3205 -1.1834 -1.1834 -1.1449 -1.1449 -1.0221 -1.0221 -0.5162 -0.5162 -0.3412 -0.3412 -0.2414 -0.2414 0.0703 0.0703 0.3922 0.3922 0.4910 0.4910 0.6831 0.6831 0.8967 0.8967 0.9461 0.9461 1.0252 1.0252 1.6475 1.6475 2.0228 2.0228 2.0936 2.0936 2.3872 2.3872 2.4567 2.4567 2.5479 2.5479 2.6625 2.6625 3.3666 3.3666 12.0681 12.0681 12.3060 12.3060 14.9373 14.9373 15.6330 15.6330 16.8396 16.8396 k = 0.1250 0.1250 0.7507 ( 2798 PWs) bands (ev): -17.5117 -17.5117 -17.4991 -17.4991 -17.2814 -17.2814 -17.2678 -17.2678 -1.3081 -1.3081 -1.1843 -1.1843 -1.1463 -1.1463 -1.0069 -1.0069 -0.4990 -0.4990 -0.3419 -0.3419 -0.2541 -0.2541 0.0239 0.0239 0.3880 0.3880 0.4780 0.4780 0.7176 0.7176 0.8981 0.8981 0.9475 0.9475 1.0214 1.0214 1.6999 1.6999 2.0270 2.0270 2.0895 2.0895 2.3911 2.3911 2.4517 2.4517 2.5472 2.5472 2.6456 2.6456 3.3153 3.3153 12.0702 12.0702 12.2757 12.2757 15.0278 15.0278 15.6405 15.6405 16.8566 16.8566 k = 0.1146 0.1146 0.7507 ( 2794 PWs) bands (ev): -17.5127 -17.5127 -17.5019 -17.5019 -17.2786 -17.2786 -17.2669 -17.2669 -1.2991 -1.2991 -1.1941 -1.1941 -1.1339 -1.1339 -0.9927 -0.9927 -0.4822 -0.4822 -0.3426 -0.3426 -0.2663 -0.2663 -0.0220 -0.0220 0.3839 0.3839 0.4644 0.4644 0.7506 0.7506 0.8994 0.8994 0.9493 0.9493 1.0183 1.0183 1.7556 1.7556 2.0315 2.0315 2.0859 2.0859 2.3946 2.3946 2.4466 2.4466 2.5466 2.5466 2.6292 2.6292 3.2610 3.2610 12.0721 12.0721 12.2468 12.2468 15.1172 15.1172 15.6488 15.6488 16.8733 16.8733 k = 0.1042 0.1042 0.7507 ( 2792 PWs) bands (ev): -17.5136 -17.5136 -17.5045 -17.5045 -17.2760 -17.2760 -17.2662 -17.2662 -1.2928 -1.2928 -1.2069 -1.2069 -1.1142 -1.1142 -0.9796 -0.9796 -0.4661 -0.4661 -0.3433 -0.3433 -0.2779 -0.2779 -0.0671 -0.0671 0.3799 0.3799 0.4506 0.4506 0.7814 0.7814 0.9006 0.9006 0.9516 0.9516 1.0156 1.0156 1.8140 1.8140 2.0363 2.0363 2.0829 2.0829 2.3980 2.3980 2.4414 2.4414 2.5460 2.5460 2.6134 2.6134 3.2041 3.2041 12.0738 12.0738 12.2196 12.2196 15.2045 15.2045 15.6576 15.6576 16.8895 16.8895 k = 0.0938 0.0937 0.7507 ( 2796 PWs) bands (ev): -17.5144 -17.5144 -17.5070 -17.5070 -17.2735 -17.2735 -17.2655 -17.2655 -1.2886 -1.2886 -1.2199 -1.2199 -1.0910 -1.0910 -0.9678 -0.9678 -0.4508 -0.4508 -0.3442 -0.3442 -0.2886 -0.2886 -0.1111 -0.1111 0.3761 0.3761 0.4369 0.4369 0.8095 0.8095 0.9016 0.9016 0.9545 0.9545 1.0134 1.0134 1.8743 1.8743 2.0414 2.0414 2.0809 2.0809 2.4011 2.4011 2.4363 2.4363 2.5454 2.5454 2.5985 2.5985 3.1446 3.1446 12.0753 12.0753 12.1944 12.1944 15.2888 15.2888 15.6667 15.6667 16.9051 16.9051 k = 0.0833 0.0833 0.7507 ( 2796 PWs) bands (ev): -17.5152 -17.5152 -17.5092 -17.5092 -17.2713 -17.2713 -17.2648 -17.2648 -1.2860 -1.2860 -1.2322 -1.2322 -1.0657 -1.0657 -0.9571 -0.9571 -0.4366 -0.4366 -0.3452 -0.3452 -0.2982 -0.2982 -0.1534 -0.1534 0.3726 0.3726 0.4236 0.4236 0.8344 0.8344 0.9026 0.9026 0.9584 0.9584 1.0116 1.0116 1.9346 1.9346 2.0470 2.0470 2.0811 2.0811 2.4039 2.4039 2.4313 2.4313 2.5449 2.5449 2.5845 2.5845 3.0828 3.0828 12.0765 12.0765 12.1714 12.1714 15.3689 15.3689 15.6760 15.6760 16.9198 16.9198 k = 0.0729 0.0729 0.7507 ( 2792 PWs) bands (ev): -17.5158 -17.5158 -17.5112 -17.5112 -17.2692 -17.2692 -17.2642 -17.2642 -1.2843 -1.2843 -1.2433 -1.2433 -1.0395 -1.0395 -0.9476 -0.9476 -0.4237 -0.4237 -0.3465 -0.3465 -0.3067 -0.3067 -0.1936 -0.1936 0.3696 0.3696 0.4110 0.4110 0.8553 0.8553 0.9035 0.9035 0.9636 0.9636 1.0101 1.0101 1.9898 1.9898 2.0531 2.0531 2.0882 2.0882 2.4064 2.4064 2.4267 2.4267 2.5444 2.5444 2.5718 2.5718 3.0189 3.0189 12.0776 12.0776 12.1507 12.1507 15.4437 15.4437 15.6852 15.6852 16.9335 16.9335 k = 0.0625 0.0625 0.7507 ( 2788 PWs) bands (ev): -17.5164 -17.5164 -17.5130 -17.5130 -17.2675 -17.2675 -17.2638 -17.2638 -1.2833 -1.2833 -1.2533 -1.2533 -1.0134 -1.0134 -0.9394 -0.9394 -0.4123 -0.4123 -0.3482 -0.3482 -0.3137 -0.3137 -0.2307 -0.2307 0.3668 0.3668 0.3993 0.3993 0.8722 0.8722 0.9042 0.9042 0.9701 0.9701 1.0090 1.0090 2.0264 2.0264 2.0578 2.0578 2.1170 2.1170 2.4084 2.4084 2.4226 2.4226 2.5440 2.5440 2.5604 2.5604 2.9532 2.9532 12.0785 12.0785 12.1326 12.1326 15.5122 15.5122 15.6940 15.6940 16.9460 16.9460 k = 0.0521 0.0521 0.7507 ( 2786 PWs) bands (ev): -17.5169 -17.5169 -17.5145 -17.5145 -17.2659 -17.2659 -17.2633 -17.2633 -1.2828 -1.2828 -1.2619 -1.2619 -0.9882 -0.9882 -0.9323 -0.9323 -0.4027 -0.4027 -0.3510 -0.3510 -0.3193 -0.3193 -0.2638 -0.2638 0.3644 0.3644 0.3888 0.3888 0.8849 0.8849 0.9049 0.9049 0.9777 0.9777 1.0081 1.0081 2.0415 2.0415 2.0593 2.0593 2.1713 2.1713 2.4095 2.4095 2.4196 2.4196 2.5437 2.5437 2.5505 2.5505 2.8857 2.8857 12.0793 12.0793 12.1170 12.1170 15.5729 15.5729 15.7021 15.7021 16.9570 16.9570 k = 0.0417 0.0417 0.7507 ( 2786 PWs) bands (ev): -17.5173 -17.5173 -17.5158 -17.5158 -17.2647 -17.2647 -17.2630 -17.2630 -1.2825 -1.2825 -1.2691 -1.2691 -0.9651 -0.9651 -0.9266 -0.9266 -0.3951 -0.3951 -0.3555 -0.3555 -0.3232 -0.3232 -0.2909 -0.2909 0.3624 0.3624 0.3797 0.3797 0.8938 0.8938 0.9053 0.9053 0.9856 0.9856 1.0073 1.0073 2.0484 2.0484 2.0593 2.0593 2.2359 2.2359 2.4092 2.4092 2.4188 2.4188 2.5420 2.5420 2.5436 2.5436 2.8170 2.8170 12.0799 12.0799 12.1042 12.1042 15.6248 15.6248 15.7092 15.7092 16.9663 16.9663 k = 0.0312 0.0312 0.7507 ( 2790 PWs) bands (ev): -17.5177 -17.5177 -17.5168 -17.5168 -17.2637 -17.2637 -17.2627 -17.2627 -1.2823 -1.2823 -1.2748 -1.2748 -0.9452 -0.9452 -0.9221 -0.9221 -0.3896 -0.3896 -0.3630 -0.3630 -0.3259 -0.3259 -0.3100 -0.3100 0.3610 0.3610 0.3723 0.3723 0.8998 0.8998 0.9057 0.9057 0.9930 0.9930 1.0068 1.0068 2.0525 2.0525 2.0588 2.0588 2.3029 2.3029 2.4076 2.4076 2.4209 2.4209 2.5356 2.5356 2.5433 2.5433 2.7472 2.7472 12.0804 12.0804 12.0941 12.0941 15.6667 15.6667 15.7151 15.7151 16.9738 16.9738 k = 0.0208 0.0208 0.7507 ( 2784 PWs) bands (ev): -17.5179 -17.5179 -17.5175 -17.5175 -17.2629 -17.2629 -17.2625 -17.2625 -1.2823 -1.2823 -1.2789 -1.2789 -0.9296 -0.9296 -0.9188 -0.9188 -0.3860 -0.3860 -0.3725 -0.3725 -0.3272 -0.3272 -0.3207 -0.3207 0.3602 0.3602 0.3668 0.3668 0.9035 0.9035 0.9060 0.9060 0.9990 0.9990 1.0064 1.0064 2.0551 2.0551 2.0583 2.0583 2.3650 2.3650 2.4059 2.4059 2.4297 2.4297 2.5308 2.5308 2.5431 2.5431 2.6768 2.6768 12.0807 12.0807 12.0869 12.0869 15.6975 15.6975 15.7195 15.7195 16.9793 16.9793 k = 0.0104 0.0104 0.7507 ( 2776 PWs) bands (ev): -17.5180 -17.5180 -17.5179 -17.5179 -17.2625 -17.2625 -17.2624 -17.2624 -1.2822 -1.2822 -1.2814 -1.2814 -0.9196 -0.9196 -0.9169 -0.9169 -0.3841 -0.3841 -0.3804 -0.3804 -0.3276 -0.3276 -0.3256 -0.3256 0.3601 0.3601 0.3630 0.3630 0.9056 0.9056 0.9063 0.9063 1.0031 1.0031 1.0060 1.0060 2.0567 2.0567 2.0579 2.0579 2.3983 2.3983 2.4048 2.4048 2.4669 2.4669 2.5277 2.5277 2.5432 2.5432 2.6071 2.6071 12.0809 12.0809 12.0826 12.0826 15.7163 15.7163 15.7222 15.7222 16.9826 16.9826 k = 0.0000 0.0000 0.7507 ( 2774 PWs) bands (ev): -17.5180 -17.5180 -17.5180 -17.5180 -17.2623 -17.2623 -17.2623 -17.2623 -1.2822 -1.2822 -1.2822 -1.2822 -0.9162 -0.9162 -0.9162 -0.9162 -0.3835 -0.3835 -0.3835 -0.3835 -0.3273 -0.3273 -0.3273 -0.3273 0.3609 0.3609 0.3609 0.3609 0.9063 0.9063 0.9063 0.9063 1.0051 1.0051 1.0051 1.0051 2.0575 2.0575 2.0575 2.0575 2.4041 2.4041 2.4041 2.4041 2.5201 2.5201 2.5201 2.5201 2.5493 2.5493 2.5493 2.5493 12.0810 12.0810 12.0810 12.0810 15.7229 15.7229 15.7229 15.7229 16.9839 16.9839 k = 0.0000 0.5000-0.0000 ( 2776 PWs) bands (ev): -17.7467 -17.7467 -17.7467 -17.7467 -17.2473 -17.2473 -17.2473 -17.2473 -1.5370 -1.5370 -1.5370 -1.5370 -0.7481 -0.7481 -0.7481 -0.7481 -0.5887 -0.5887 -0.5887 -0.5887 -0.0100 -0.0100 -0.0100 -0.0100 0.4179 0.4179 0.4179 0.4179 1.0457 1.0457 1.0457 1.0457 1.5827 1.5827 1.5827 1.5827 1.8126 1.8126 1.8126 1.8126 2.1873 2.1873 2.1873 2.1873 3.1547 3.1547 3.1547 3.1547 3.3467 3.3467 3.3467 3.3467 9.9331 9.9331 9.9331 9.9331 14.4075 14.4075 14.4075 14.4075 16.8226 16.8226 k = 0.0000 0.5000 0.0147 ( 2776 PWs) bands (ev): -17.7465 -17.7465 -17.7464 -17.7464 -17.2474 -17.2474 -17.2473 -17.2473 -1.5370 -1.5370 -1.5357 -1.5357 -0.7512 -0.7512 -0.7496 -0.7496 -0.5865 -0.5865 -0.5854 -0.5854 -0.0113 -0.0113 -0.0091 -0.0091 0.4133 0.4133 0.4189 0.4189 1.0421 1.0421 1.0478 1.0478 1.5769 1.5769 1.5874 1.5874 1.8133 1.8133 1.8157 1.8157 2.1871 2.1871 2.1872 2.1872 3.1519 3.1519 3.1552 3.1552 3.3454 3.3454 3.3478 3.3478 9.9351 9.9351 9.9352 9.9352 14.4093 14.4093 14.4098 14.4098 16.8216 16.8216 k = 0.0000 0.5000 0.0294 ( 2788 PWs) bands (ev): -17.7459 -17.7459 -17.7458 -17.7458 -17.2475 -17.2475 -17.2473 -17.2473 -1.5358 -1.5358 -1.5333 -1.5333 -0.7586 -0.7586 -0.7553 -0.7553 -0.5792 -0.5792 -0.5771 -0.5771 -0.0132 -0.0132 -0.0087 -0.0087 0.4053 0.4053 0.4164 0.4164 1.0368 1.0368 1.0482 1.0482 1.5702 1.5702 1.5906 1.5906 1.8177 1.8177 1.8222 1.8222 2.1864 2.1864 2.1866 2.1866 3.1469 3.1469 3.1533 3.1533 3.3440 3.3440 3.3486 3.3486 9.9413 9.9413 9.9414 9.9414 14.4153 14.4153 14.4162 14.4162 16.8202 16.8202 k = 0.0000 0.5000 0.0442 ( 2780 PWs) bands (ev): -17.7448 -17.7448 -17.7447 -17.7447 -17.2476 -17.2476 -17.2474 -17.2474 -1.5333 -1.5333 -1.5295 -1.5295 -0.7689 -0.7689 -0.7640 -0.7640 -0.5679 -0.5679 -0.5646 -0.5646 -0.0155 -0.0155 -0.0087 -0.0087 0.3942 0.3942 0.4108 0.4108 1.0303 1.0303 1.0472 1.0472 1.5632 1.5632 1.5924 1.5924 1.8260 1.8260 1.8316 1.8316 2.1854 2.1854 2.1856 2.1856 3.1396 3.1396 3.1489 3.1489 3.3428 3.3428 3.3493 3.3493 9.9515 9.9515 9.9518 9.9518 14.4253 14.4253 14.4268 14.4268 16.8184 16.8184 k = 0.0000 0.5000 0.0589 ( 2780 PWs) bands (ev): -17.7433 -17.7433 -17.7432 -17.7432 -17.2477 -17.2477 -17.2474 -17.2474 -1.5297 -1.5297 -1.5246 -1.5246 -0.7814 -0.7814 -0.7749 -0.7749 -0.5536 -0.5536 -0.5492 -0.5492 -0.0184 -0.0184 -0.0093 -0.0093 0.3801 0.3801 0.4020 0.4020 1.0224 1.0224 1.0446 1.0446 1.5560 1.5560 1.5929 1.5929 1.8374 1.8374 1.8434 1.8434 2.1841 2.1841 2.1843 2.1843 3.1299 3.1299 3.1417 3.1417 3.3419 3.3419 3.3499 3.3499 9.9658 9.9658 9.9662 9.9662 14.4394 14.4394 14.4413 14.4413 16.8163 16.8163 k = 0.0000 0.5000 0.0736 ( 2778 PWs) bands (ev): -17.7415 -17.7415 -17.7414 -17.7414 -17.2478 -17.2478 -17.2475 -17.2475 -1.5248 -1.5248 -1.5185 -1.5185 -0.7950 -0.7950 -0.7870 -0.7870 -0.5371 -0.5371 -0.5315 -0.5315 -0.0223 -0.0223 -0.0108 -0.0108 0.3634 0.3634 0.3905 0.3905 1.0134 1.0134 1.0407 1.0407 1.5491 1.5491 1.5922 1.5922 1.8515 1.8515 1.8570 1.8570 2.1826 2.1826 2.1826 2.1826 3.1177 3.1177 3.1316 3.1316 3.3415 3.3415 3.3508 3.3508 9.9842 9.9842 9.9846 9.9846 14.4573 14.4573 14.4598 14.4598 16.8136 16.8136 k = 0.0000 0.5000 0.0883 ( 2778 PWs) bands (ev): -17.7392 -17.7392 -17.7390 -17.7390 -17.2480 -17.2480 -17.2476 -17.2476 -1.5188 -1.5188 -1.5111 -1.5111 -0.8092 -0.8092 -0.7995 -0.7995 -0.5193 -0.5193 -0.5125 -0.5125 -0.0274 -0.0274 -0.0135 -0.0135 0.3448 0.3448 0.3767 0.3767 1.0035 1.0035 1.0356 1.0356 1.5425 1.5425 1.5908 1.5908 1.8676 1.8676 1.8719 1.8719 2.1807 2.1807 2.1808 2.1808 3.1031 3.1031 3.1185 3.1185 3.3420 3.3420 3.3519 3.3519 10.0064 10.0064 10.0070 10.0070 14.4791 14.4791 14.4822 14.4822 16.8105 16.8105 k = 0.0000 0.5000 0.1030 ( 2780 PWs) bands (ev): -17.7365 -17.7365 -17.7363 -17.7363 -17.2482 -17.2482 -17.2478 -17.2478 -1.5117 -1.5117 -1.5026 -1.5026 -0.8236 -0.8236 -0.8123 -0.8123 -0.5004 -0.5004 -0.4925 -0.4925 -0.0340 -0.0340 -0.0177 -0.0177 0.3248 0.3248 0.3613 0.3613 0.9929 0.9929 1.0294 1.0294 1.5364 1.5364 1.5886 1.5886 1.8851 1.8851 1.8875 1.8875 2.1784 2.1784 2.1788 2.1788 3.0857 3.0857 3.1022 3.1022 3.3435 3.3435 3.3537 3.3537 10.0326 10.0326 10.0332 10.0332 14.5046 14.5046 14.5083 14.5083 16.8069 16.8069 k = 0.0000 0.5000 0.1177 ( 2780 PWs) bands (ev): -17.7334 -17.7334 -17.7332 -17.7332 -17.2484 -17.2484 -17.2479 -17.2479 -1.5035 -1.5035 -1.4930 -1.4930 -0.8379 -0.8379 -0.8249 -0.8249 -0.4807 -0.4807 -0.4716 -0.4716 -0.0425 -0.0425 -0.0242 -0.0242 0.3044 0.3044 0.3449 0.3449 0.9816 0.9816 1.0223 1.0223 1.5307 1.5307 1.5859 1.5859 1.9034 1.9034 1.9034 1.9034 2.1761 2.1761 2.1769 2.1769 3.0658 3.0658 3.0828 3.0828 3.3461 3.3461 3.3561 3.3561 10.0624 10.0624 10.0631 10.0631 14.5336 14.5336 14.5380 14.5380 16.8027 16.8027 k = 0.0000 0.5000 0.1325 ( 2788 PWs) bands (ev): -17.7299 -17.7299 -17.7297 -17.7297 -17.2487 -17.2487 -17.2482 -17.2482 -1.4942 -1.4942 -1.4823 -1.4823 -0.8518 -0.8518 -0.8371 -0.8371 -0.4604 -0.4604 -0.4502 -0.4502 -0.0535 -0.0535 -0.0334 -0.0334 0.2844 0.2844 0.3282 0.3282 0.9698 0.9698 1.0144 1.0144 1.5253 1.5253 1.5827 1.5827 1.9192 1.9192 1.9219 1.9219 2.1737 2.1737 2.1751 2.1751 3.0433 3.0433 3.0604 3.0604 3.3498 3.3498 3.3592 3.3592 10.0959 10.0959 10.0966 10.0966 14.5659 14.5659 14.5711 14.5711 16.7979 16.7979 k = 0.0000 0.5000 0.1472 ( 2786 PWs) bands (ev): -17.7261 -17.7261 -17.7258 -17.7258 -17.2490 -17.2490 -17.2484 -17.2484 -1.4839 -1.4839 -1.4705 -1.4705 -0.8653 -0.8653 -0.8487 -0.8487 -0.4397 -0.4397 -0.4284 -0.4284 -0.0674 -0.0674 -0.0463 -0.0463 0.2660 0.2660 0.3121 0.3121 0.9576 0.9576 1.0060 1.0060 1.5202 1.5202 1.5791 1.5791 1.9342 1.9342 1.9400 1.9400 2.1715 2.1715 2.1737 2.1737 3.0183 3.0183 3.0352 3.0352 3.3547 3.3547 3.3632 3.3632 10.1329 10.1329 10.1337 10.1337 14.6013 14.6013 14.6073 14.6073 16.7924 16.7924 k = 0.0000 0.5000 0.1619 ( 2790 PWs) bands (ev): -17.7219 -17.7219 -17.7216 -17.7216 -17.2493 -17.2493 -17.2487 -17.2487 -1.4726 -1.4726 -1.4576 -1.4576 -0.8782 -0.8782 -0.8598 -0.8598 -0.4187 -0.4187 -0.4064 -0.4064 -0.0847 -0.0847 -0.0635 -0.0635 0.2501 0.2501 0.2973 0.2973 0.9453 0.9453 0.9971 0.9971 1.5152 1.5152 1.5749 1.5749 1.9481 1.9481 1.9572 1.9572 2.1697 2.1697 2.1728 2.1728 2.9910 2.9910 3.0075 3.0075 3.3606 3.3606 3.3682 3.3682 10.1733 10.1733 10.1741 10.1741 14.6396 14.6396 14.6465 14.6465 16.7861 16.7861 k = 0.0000 0.5000 0.1766 ( 2794 PWs) bands (ev): -17.7173 -17.7173 -17.7170 -17.7170 -17.2497 -17.2497 -17.2490 -17.2490 -1.4604 -1.4604 -1.4439 -1.4439 -0.8905 -0.8905 -0.8701 -0.8701 -0.3975 -0.3975 -0.3842 -0.3842 -0.1056 -0.1056 -0.0852 -0.0852 0.2373 0.2373 0.2844 0.2844 0.9327 0.9327 0.9879 0.9879 1.5102 1.5102 1.5702 1.5702 1.9603 1.9603 1.9729 1.9729 2.1686 2.1686 2.1728 2.1728 2.9615 2.9615 2.9774 2.9774 3.3675 3.3675 3.3740 3.3740 10.2169 10.2169 10.2177 10.2177 14.6804 14.6804 14.6883 14.6883 16.7791 16.7791 k = 0.0000 0.5000 0.1913 ( 2802 PWs) bands (ev): -17.7123 -17.7123 -17.7120 -17.7120 -17.2502 -17.2502 -17.2495 -17.2495 -1.4473 -1.4473 -1.4292 -1.4292 -0.9019 -0.9019 -0.8795 -0.8795 -0.3762 -0.3762 -0.3622 -0.3622 -0.1302 -0.1302 -0.1116 -0.1116 0.2281 0.2281 0.2738 0.2738 0.9201 0.9201 0.9783 0.9783 1.5051 1.5051 1.5648 1.5648 1.9704 1.9704 1.9866 1.9866 2.1687 2.1687 2.1740 2.1740 2.9300 2.9300 2.9451 2.9451 3.3753 3.3753 3.3807 3.3807 10.2636 10.2636 10.2645 10.2645 14.7234 14.7234 14.7324 14.7324 16.7711 16.7711 k = 0.0000 0.5000 0.2061 ( 2802 PWs) bands (ev): -17.7071 -17.7071 -17.7067 -17.7067 -17.2507 -17.2507 -17.2499 -17.2499 -1.4336 -1.4336 -1.4137 -1.4137 -0.9125 -0.9125 -0.8879 -0.8879 -0.3552 -0.3552 -0.3403 -0.3403 -0.1583 -0.1583 -0.1422 -0.1422 0.2224 0.2224 0.2657 0.2657 0.9075 0.9075 0.9688 0.9688 1.4996 1.4996 1.5587 1.5587 1.9780 1.9780 1.9976 1.9976 2.1704 2.1704 2.1767 2.1767 2.8968 2.8968 2.9111 2.9111 3.3840 3.3840 3.3882 3.3882 10.3133 10.3133 10.3142 10.3142 14.7683 14.7683 14.7786 14.7786 16.7623 16.7623 k = 0.0000 0.5000 0.2208 ( 2802 PWs) bands (ev): -17.7015 -17.7015 -17.7011 -17.7011 -17.2512 -17.2512 -17.2504 -17.2504 -1.4191 -1.4191 -1.3975 -1.3975 -0.9221 -0.9221 -0.8953 -0.8953 -0.3346 -0.3346 -0.3193 -0.3193 -0.1893 -0.1893 -0.1758 -0.1758 0.2199 0.2199 0.2602 0.2602 0.8950 0.8950 0.9591 0.9591 1.4937 1.4937 1.5517 1.5517 1.9828 1.9828 2.0054 2.0054 2.1742 2.1742 2.1810 2.1810 2.8621 2.8621 2.8755 2.8755 3.3934 3.3934 3.3966 3.3966 10.3657 10.3657 10.3666 10.3666 14.8147 14.8147 14.8263 14.8263 16.7524 16.7524 k = 0.0000 0.5000 0.2355 ( 2798 PWs) bands (ev): -17.6955 -17.6955 -17.6951 -17.6951 -17.2518 -17.2518 -17.2510 -17.2510 -1.4041 -1.4041 -1.3806 -1.3806 -0.9307 -0.9307 -0.9015 -0.9015 -0.3158 -0.3158 -0.3008 -0.3008 -0.2216 -0.2216 -0.2103 -0.2103 0.2201 0.2201 0.2570 0.2570 0.8826 0.8826 0.9496 0.9496 1.4872 1.4872 1.5438 1.5438 1.9845 1.9845 2.0096 2.0096 2.1802 2.1802 2.1870 2.1870 2.8262 2.8262 2.8386 2.8386 3.4036 3.4036 3.4058 3.4058 10.4208 10.4208 10.4217 10.4217 14.8621 14.8621 14.8751 14.8751 16.7416 16.7416 k = 0.0000 0.5000 0.2502 ( 2798 PWs) bands (ev): -17.6893 -17.6893 -17.6889 -17.6889 -17.2525 -17.2525 -17.2516 -17.2516 -1.3886 -1.3886 -1.3633 -1.3633 -0.9381 -0.9381 -0.9066 -0.9066 -0.3045 -0.3045 -0.2937 -0.2937 -0.2490 -0.2490 -0.2361 -0.2361 0.2226 0.2226 0.2558 0.2558 0.8704 0.8704 0.9401 0.9401 1.4800 1.4800 1.5348 1.5348 1.9833 1.9833 2.0103 2.0103 2.1883 2.1883 2.1946 2.1946 2.7892 2.7892 2.8006 2.8006 3.4145 3.4145 3.4156 3.4156 10.4784 10.4784 10.4793 10.4793 14.9098 14.9098 14.9245 14.9245 16.7299 16.7299 k = 0.0000 0.5000 0.2649 ( 2798 PWs) bands (ev): -17.6828 -17.6828 -17.6824 -17.6824 -17.2533 -17.2533 -17.2524 -17.2524 -1.3728 -1.3728 -1.3456 -1.3456 -0.9443 -0.9443 -0.9104 -0.9104 -0.3199 -0.3199 -0.3166 -0.3166 -0.2517 -0.2517 -0.2339 -0.2339 0.2269 0.2269 0.2564 0.2564 0.8584 0.8584 0.9307 0.9307 1.4720 1.4720 1.5247 1.5247 1.9794 1.9794 2.0077 2.0077 2.1984 2.1984 2.2036 2.2036 2.7514 2.7514 2.7617 2.7617 3.4259 3.4259 3.4261 3.4261 10.5383 10.5383 10.5392 10.5392 14.9575 14.9575 14.9738 14.9738 16.7174 16.7174 k = 0.0000 0.5000 0.2797 ( 2802 PWs) bands (ev): -17.6761 -17.6761 -17.6756 -17.6756 -17.2541 -17.2541 -17.2532 -17.2532 -1.3568 -1.3568 -1.3278 -1.3278 -0.9493 -0.9493 -0.9128 -0.9128 -0.3561 -0.3561 -0.3554 -0.3554 -0.2361 -0.2361 -0.2168 -0.2168 0.2328 0.2328 0.2584 0.2584 0.8466 0.8466 0.9216 0.9216 1.4631 1.4631 1.5134 1.5134 1.9729 1.9729 2.0023 2.0023 2.2098 2.2098 2.2135 2.2135 2.7130 2.7130 2.7223 2.7223 3.4371 3.4371 3.4378 3.4378 10.6003 10.6003 10.6012 10.6012 15.0042 15.0042 15.0223 15.0223 16.7043 16.7043 k = 0.0000 0.5000 0.2944 ( 2802 PWs) bands (ev): -17.6691 -17.6691 -17.6685 -17.6685 -17.2550 -17.2550 -17.2541 -17.2541 -1.3408 -1.3408 -1.3101 -1.3101 -0.9527 -0.9527 -0.9137 -0.9137 -0.3999 -0.3999 -0.3961 -0.3961 -0.2165 -0.2165 -0.1966 -0.1966 0.2399 0.2399 0.2617 0.2617 0.8351 0.8351 0.9127 0.9127 1.4532 1.4532 1.5008 1.5008 1.9642 1.9642 1.9943 1.9943 2.2222 2.2222 2.2243 2.2243 2.6744 2.6744 2.6826 2.6826 3.4487 3.4487 3.4502 3.4502 10.6643 10.6643 10.6652 10.6652 15.0492 15.0492 15.0692 15.0692 16.6910 16.6910 k = 0.0000 0.5000 0.3091 ( 2802 PWs) bands (ev): -17.6618 -17.6618 -17.6612 -17.6612 -17.2560 -17.2560 -17.2550 -17.2550 -1.3248 -1.3248 -1.2926 -1.2926 -0.9545 -0.9545 -0.9131 -0.9131 -0.4452 -0.4452 -0.4386 -0.4386 -0.1958 -0.1958 -0.1755 -0.1755 0.2480 0.2480 0.2659 0.2659 0.8240 0.8240 0.9041 0.9041 1.4423 1.4423 1.4869 1.4869 1.9534 1.9534 1.9843 1.9843 2.2352 2.2352 2.2355 2.2355 2.6357 2.6357 2.6428 2.6428 3.4607 3.4607 3.4629 3.4629 10.7302 10.7302 10.7311 10.7311 15.0917 15.0917 15.1135 15.1135 16.6780 16.6780 k = 0.0000 0.5000 0.3238 ( 2798 PWs) bands (ev): -17.6544 -17.6544 -17.6537 -17.6537 -17.2571 -17.2571 -17.2561 -17.2561 -1.3092 -1.3092 -1.2756 -1.2756 -0.9546 -0.9546 -0.9108 -0.9108 -0.4913 -0.4913 -0.4818 -0.4818 -0.1748 -0.1748 -0.1542 -0.1542 0.2568 0.2568 0.2709 0.2709 0.8133 0.8133 0.8959 0.8959 1.4304 1.4304 1.4718 1.4718 1.9409 1.9409 1.9724 1.9724 2.2469 2.2469 2.2485 2.2485 2.5972 2.5972 2.6032 2.6032 3.4731 3.4731 3.4760 3.4760 10.7977 10.7977 10.7986 10.7986 15.1306 15.1306 15.1541 15.1541 16.6660 16.6660 k = 0.0000 0.5000 0.3385 ( 2798 PWs) bands (ev): -17.6467 -17.6467 -17.6461 -17.6461 -17.2583 -17.2583 -17.2573 -17.2573 -1.2940 -1.2940 -1.2596 -1.2596 -0.9528 -0.9528 -0.9068 -0.9068 -0.5375 -0.5375 -0.5252 -0.5252 -0.1537 -0.1537 -0.1329 -0.1329 0.2663 0.2663 0.2764 0.2764 0.8030 0.8030 0.8881 0.8881 1.4173 1.4173 1.4552 1.4552 1.9266 1.9266 1.9589 1.9589 2.2585 2.2585 2.2618 2.2618 2.5591 2.5591 2.5640 2.5640 3.4858 3.4858 3.4893 3.4893 10.8668 10.8668 10.8677 10.8677 15.1648 15.1648 15.1898 15.1898 16.6560 16.6560 k = 0.0000 0.5000 0.3532 ( 2798 PWs) bands (ev): -17.6389 -17.6389 -17.6382 -17.6382 -17.2596 -17.2596 -17.2586 -17.2586 -1.2794 -1.2794 -1.2447 -1.2447 -0.9489 -0.9489 -0.9011 -0.9011 -0.5835 -0.5835 -0.5682 -0.5682 -0.1326 -0.1326 -0.1117 -0.1117 0.2761 0.2761 0.2823 0.2823 0.7931 0.7931 0.8807 0.8807 1.4031 1.4031 1.4373 1.4373 1.9109 1.9109 1.9440 1.9440 2.2701 2.2701 2.2750 2.2750 2.5217 2.5217 2.5254 2.5254 3.4987 3.4987 3.5028 3.5028 10.9373 10.9373 10.9381 10.9381 15.1933 15.1933 15.2193 15.2193 16.6491 16.6491 k = 0.0000 0.5000 0.3680 ( 2796 PWs) bands (ev): -17.6309 -17.6309 -17.6302 -17.6302 -17.2610 -17.2610 -17.2600 -17.2600 -1.2657 -1.2657 -1.2313 -1.2313 -0.9429 -0.9429 -0.8936 -0.8936 -0.6289 -0.6289 -0.6105 -0.6105 -0.1115 -0.1115 -0.0907 -0.0907 0.2863 0.2863 0.2884 0.2884 0.7838 0.7838 0.8738 0.8738 1.3877 1.3877 1.4181 1.4181 1.8936 1.8936 1.9276 1.9276 2.2815 2.2815 2.2880 2.2880 2.4851 2.4851 2.4877 2.4877 3.5119 3.5119 3.5165 3.5165 11.0089 11.0089 11.0098 11.0098 15.2148 15.2148 15.2413 15.2413 16.6464 16.6464 k = 0.0000 0.5000 0.3827 ( 2792 PWs) bands (ev): -17.6228 -17.6228 -17.6220 -17.6220 -17.2625 -17.2625 -17.2615 -17.2615 -1.2529 -1.2529 -1.2197 -1.2197 -0.9348 -0.9348 -0.8844 -0.8844 -0.6734 -0.6734 -0.6515 -0.6515 -0.0905 -0.0905 -0.0698 -0.0698 0.2945 0.2945 0.2967 0.2967 0.7750 0.7750 0.8673 0.8673 1.3714 1.3714 1.3977 1.3977 1.8751 1.8751 1.9101 1.9101 2.2928 2.2928 2.3006 2.3006 2.4497 2.4497 2.4509 2.4509 3.5251 3.5251 3.5302 3.5302 11.0817 11.0817 11.0826 11.0826 15.2284 15.2284 15.2546 15.2546 16.6491 16.6491 k = 0.0000 0.5000 0.3974 ( 2796 PWs) bands (ev): -17.6146 -17.6146 -17.6138 -17.6138 -17.2642 -17.2642 -17.2631 -17.2631 -1.2413 -1.2413 -1.2101 -1.2101 -0.9248 -0.9248 -0.8737 -0.8737 -0.7166 -0.7166 -0.6908 -0.6908 -0.0696 -0.0696 -0.0491 -0.0491 0.3006 0.3006 0.3070 0.3070 0.7668 0.7668 0.8613 0.8613 1.3539 1.3539 1.3760 1.3760 1.8552 1.8552 1.8913 1.8913 2.3037 2.3037 2.3125 2.3125 2.4153 2.4153 2.4157 2.4157 3.5383 3.5383 3.5438 3.5438 11.1554 11.1554 11.1563 11.1563 15.2333 15.2333 15.2584 15.2584 16.6583 16.6583 k = 0.0000 0.5000 0.4121 ( 2800 PWs) bands (ev): -17.6063 -17.6063 -17.6054 -17.6054 -17.2659 -17.2659 -17.2649 -17.2649 -1.2310 -1.2310 -1.2028 -1.2028 -0.9133 -0.9133 -0.8617 -0.8617 -0.7580 -0.7580 -0.7277 -0.7277 -0.0488 -0.0488 -0.0286 -0.0286 0.3065 0.3065 0.3173 0.3173 0.7590 0.7590 0.8558 0.8558 1.3356 1.3356 1.3533 1.3533 1.8342 1.8342 1.8714 1.8714 2.3144 2.3144 2.3231 2.3231 2.3810 2.3810 2.3841 2.3841 3.5515 3.5515 3.5574 3.5574 11.2298 11.2298 11.2308 11.2308 15.2289 15.2289 15.2520 15.2520 16.6746 16.6746 k = 0.0000 0.5000 0.4268 ( 2792 PWs) bands (ev): -17.5980 -17.5980 -17.5970 -17.5970 -17.2678 -17.2678 -17.2667 -17.2667 -1.2221 -1.2221 -1.1978 -1.1978 -0.9014 -0.9014 -0.8498 -0.8498 -0.7959 -0.7959 -0.7607 -0.7607 -0.0281 -0.0281 -0.0082 -0.0082 0.3122 0.3122 0.3273 0.3273 0.7521 0.7521 0.8508 0.8508 1.3164 1.3164 1.3296 1.3296 1.8122 1.8122 1.8505 1.8505 2.3245 2.3245 2.3279 2.3279 2.3485 2.3485 2.3593 2.3593 3.5647 3.5647 3.5709 3.5709 11.3048 11.3048 11.3059 11.3059 15.2153 15.2153 15.2355 15.2355 16.6984 16.6984 k = 0.0000 0.5000 0.4416 ( 2792 PWs) bands (ev): -17.5896 -17.5896 -17.5885 -17.5885 -17.2698 -17.2698 -17.2687 -17.2687 -1.2148 -1.2148 -1.1954 -1.1954 -0.8916 -0.8916 -0.8509 -0.8509 -0.8176 -0.8176 -0.7874 -0.7874 -0.0075 -0.0075 0.0119 0.0119 0.3176 0.3176 0.3371 0.3371 0.7457 0.7457 0.8462 0.8462 1.2964 1.2964 1.3050 1.3050 1.7892 1.7892 1.8286 1.8286 2.3119 2.3119 2.3158 2.3158 2.3360 2.3360 2.3563 2.3563 3.5776 3.5776 3.5841 3.5841 11.3804 11.3804 11.3815 11.3815 15.1925 15.1925 15.2092 15.2092 16.7294 16.7294 k = 0.0000 0.5000 0.4563 ( 2792 PWs) bands (ev): -17.5811 -17.5811 -17.5800 -17.5800 -17.2719 -17.2719 -17.2709 -17.2709 -1.2095 -1.2095 -1.1956 -1.1956 -0.8889 -0.8889 -0.8792 -0.8792 -0.8082 -0.8082 -0.8025 -0.8025 0.0129 0.0129 0.0319 0.0319 0.3227 0.3227 0.3465 0.3465 0.7399 0.7399 0.8421 0.8421 1.2757 1.2757 1.2797 1.2797 1.7655 1.7655 1.8060 1.8060 2.2858 2.2858 2.2864 2.2864 2.3453 2.3453 2.3645 2.3645 3.5904 3.5904 3.5971 3.5971 11.4562 11.4562 11.4575 11.4575 15.1611 15.1611 15.1740 15.1740 16.7671 16.7671 k = 0.0000 0.5000 0.4710 ( 2788 PWs) bands (ev): -17.5727 -17.5727 -17.5715 -17.5715 -17.2741 -17.2741 -17.2731 -17.2731 -1.2065 -1.2065 -1.1986 -1.1986 -0.9106 -0.9106 -0.8976 -0.8976 -0.8018 -0.8018 -0.7917 -0.7917 0.0332 0.0332 0.0517 0.0517 0.3273 0.3273 0.3553 0.3553 0.7349 0.7349 0.8383 0.8383 1.2538 1.2538 1.2546 1.2546 1.7411 1.7411 1.7827 1.7827 2.2582 2.2582 2.2594 2.2594 2.3547 2.3547 2.3743 2.3743 3.6029 3.6029 3.6099 3.6099 11.5322 11.5322 11.5336 11.5336 15.1221 15.1221 15.1307 15.1307 16.8108 16.8108 k = 0.0000 0.5000 0.4857 ( 2780 PWs) bands (ev): -17.5643 -17.5643 -17.5631 -17.5631 -17.2765 -17.2765 -17.2755 -17.2755 -1.2060 -1.2060 -1.2045 -1.2045 -0.9394 -0.9394 -0.9130 -0.9130 -0.7896 -0.7896 -0.7735 -0.7735 0.0533 0.0533 0.0713 0.0713 0.3315 0.3315 0.3635 0.3635 0.7307 0.7307 0.8349 0.8349 1.2276 1.2276 1.2332 1.2332 1.7164 1.7164 1.7589 1.7589 2.2315 2.2315 2.2340 2.2340 2.3638 2.3638 2.3840 2.3840 3.6150 3.6150 3.6222 3.6222 11.6082 11.6082 11.6098 11.6098 15.0764 15.0764 15.0808 15.0808 16.8595 16.8595 k = 0.0000 0.5000 0.5004 ( 2780 PWs) bands (ev): -17.5560 -17.5560 -17.5547 -17.5547 -17.2789 -17.2789 -17.2780 -17.2780 -1.2133 -1.2133 -1.2088 -1.2088 -0.9643 -0.9643 -0.9294 -0.9294 -0.7721 -0.7721 -0.7545 -0.7545 0.0730 0.0730 0.0908 0.0908 0.3353 0.3353 0.3710 0.3710 0.7270 0.7270 0.8316 0.8316 1.2012 1.2012 1.2115 1.2115 1.6914 1.6914 1.7347 1.7347 2.2064 2.2064 2.2100 2.2100 2.3725 2.3725 2.3935 2.3935 3.6268 3.6268 3.6342 3.6342 11.6840 11.6840 11.6858 11.6858 15.0250 15.0250 15.0252 15.0252 16.9121 16.9121 k = 0.0000 0.5000 0.5152 ( 2780 PWs) bands (ev): -17.5477 -17.5477 -17.5463 -17.5463 -17.2815 -17.2815 -17.2806 -17.2806 -1.2249 -1.2249 -1.2150 -1.2150 -0.9845 -0.9845 -0.9438 -0.9438 -0.7523 -0.7523 -0.7350 -0.7350 0.0925 0.0925 0.1100 0.1100 0.3389 0.3389 0.3778 0.3778 0.7240 0.7240 0.8285 0.8285 1.1747 1.1747 1.1898 1.1898 1.6664 1.6664 1.7103 1.7103 2.1827 2.1827 2.1874 2.1874 2.3808 2.3808 2.4026 2.4026 3.6381 3.6381 3.6457 3.6457 11.7594 11.7594 11.7615 11.7615 14.9652 14.9652 14.9690 14.9690 16.9679 16.9679 k = 0.0000 0.5000 0.5299 ( 2790 PWs) bands (ev): -17.5396 -17.5396 -17.5382 -17.5382 -17.2842 -17.2842 -17.2833 -17.2833 -1.2388 -1.2388 -1.2248 -1.2248 -1.0000 -1.0000 -0.9555 -0.9555 -0.7313 -0.7313 -0.7155 -0.7155 0.1114 0.1114 0.1290 0.1290 0.3422 0.3422 0.3838 0.3838 0.7214 0.7214 0.8251 0.8251 1.1484 1.1484 1.1682 1.1682 1.6416 1.6416 1.6859 1.6859 2.1605 2.1605 2.1663 2.1663 2.3886 2.3886 2.4113 2.4113 3.6490 3.6490 3.6567 3.6567 11.8342 11.8342 11.8366 11.8366 14.9018 14.9018 14.9094 14.9094 17.0258 17.0258 k = 0.0000 0.5000 0.5446 ( 2794 PWs) bands (ev): -17.5317 -17.5317 -17.5301 -17.5301 -17.2870 -17.2870 -17.2861 -17.2861 -1.2546 -1.2546 -1.2378 -1.2378 -1.0108 -1.0108 -0.9644 -0.9644 -0.7100 -0.7100 -0.6960 -0.6960 0.1298 0.1298 0.1477 0.1477 0.3456 0.3456 0.3891 0.3891 0.7195 0.7195 0.8218 0.8218 1.1225 1.1225 1.1469 1.1469 1.6173 1.6173 1.6617 1.6617 2.1399 2.1399 2.1466 2.1466 2.3961 2.3961 2.4195 2.4195 3.6594 3.6594 3.6672 3.6672 11.9082 11.9082 11.9110 11.9110 14.8359 14.8359 14.8471 14.8471 17.0852 17.0852 k = 0.0000 0.5000 0.5593 ( 2794 PWs) bands (ev): -17.5239 -17.5239 -17.5223 -17.5223 -17.2898 -17.2898 -17.2890 -17.2890 -1.2716 -1.2716 -1.2533 -1.2533 -1.0177 -1.0177 -0.9707 -0.9707 -0.6889 -0.6889 -0.6768 -0.6768 0.1473 0.1473 0.1662 0.1662 0.3493 0.3493 0.3937 0.3937 0.7180 0.7180 0.8182 0.8182 1.0972 1.0972 1.1262 1.1262 1.5937 1.5937 1.6379 1.6379 2.1206 2.1206 2.1283 2.1283 2.4031 2.4031 2.4272 2.4272 3.6692 3.6692 3.6772 3.6772 11.9811 11.9811 11.9844 11.9844 14.7686 14.7686 14.7831 14.7831 17.1451 17.1451 k = 0.0000 0.5000 0.5740 ( 2802 PWs) bands (ev): -17.5163 -17.5163 -17.5146 -17.5146 -17.2927 -17.2927 -17.2920 -17.2920 -1.2893 -1.2893 -1.2703 -1.2703 -1.0215 -1.0215 -0.9749 -0.9749 -0.6681 -0.6681 -0.6582 -0.6582 0.1636 0.1636 0.1842 0.1842 0.3534 0.3534 0.3975 0.3975 0.7168 0.7168 0.8142 0.8142 1.0726 1.0726 1.1060 1.1060 1.5711 1.5711 1.6148 1.6148 2.1027 2.1027 2.1113 2.1113 2.4097 2.4097 2.4344 2.4344 3.6784 3.6784 3.6865 3.6865 12.0525 12.0525 12.0564 12.0564 14.7006 14.7006 14.7181 14.7181 17.2049 17.2049 k = 0.0000 0.5000 0.5887 ( 2806 PWs) bands (ev): -17.5091 -17.5091 -17.5073 -17.5073 -17.2956 -17.2956 -17.2950 -17.2950 -1.3070 -1.3070 -1.2880 -1.2880 -1.0229 -1.0229 -0.9775 -0.9775 -0.6481 -0.6481 -0.6403 -0.6403 0.1785 0.1785 0.2017 0.2017 0.3583 0.3583 0.4007 0.4007 0.7159 0.7159 0.8096 0.8096 1.0491 1.0491 1.0869 1.0869 1.5496 1.5496 1.5925 1.5925 2.0863 2.0863 2.0958 2.0958 2.4158 2.4158 2.4411 2.4411 3.6870 3.6870 3.6952 3.6952 12.1223 12.1223 12.1267 12.1267 14.6328 14.6328 14.6531 14.6531 17.2641 17.2641 k = 0.0000 0.5000 0.6035 ( 2810 PWs) bands (ev): -17.5021 -17.5021 -17.5002 -17.5002 -17.2986 -17.2986 -17.2980 -17.2980 -1.3243 -1.3243 -1.3056 -1.3056 -1.0227 -1.0227 -0.9787 -0.9787 -0.6289 -0.6289 -0.6234 -0.6234 0.1916 0.1916 0.2186 0.2186 0.3645 0.3645 0.4036 0.4036 0.7150 0.7150 0.8043 0.8043 1.0268 1.0268 1.0687 1.0687 1.5295 1.5295 1.5713 1.5713 2.0711 2.0711 2.0816 2.0816 2.4214 2.4214 2.4472 2.4472 3.6950 3.6950 3.7033 3.7033 12.1898 12.1898 12.1950 12.1950 14.5658 14.5658 14.5888 14.5888 17.3219 17.3219 k = 0.0000 0.5000 0.6182 ( 2802 PWs) bands (ev): -17.4955 -17.4955 -17.4935 -17.4935 -17.3014 -17.3014 -17.3009 -17.3009 -1.3407 -1.3407 -1.3226 -1.3226 -1.0215 -1.0215 -0.9790 -0.9790 -0.6109 -0.6109 -0.6075 -0.6075 0.2027 0.2027 0.2347 0.2347 0.3720 0.3720 0.4060 0.4060 0.7143 0.7143 0.7985 0.7985 1.0060 1.0060 1.0519 1.0519 1.5109 1.5109 1.5514 1.5514 2.0574 2.0574 2.0687 2.0687 2.4265 2.4265 2.4528 2.4528 3.7023 3.7023 3.7107 3.7107 12.2547 12.2547 12.2607 12.2607 14.5006 14.5006 14.5260 14.5260 17.3779 17.3779 k = 0.0000 0.5000 0.6329 ( 2798 PWs) bands (ev): -17.4893 -17.4893 -17.4872 -17.4872 -17.3043 -17.3043 -17.3038 -17.3038 -1.3560 -1.3560 -1.3385 -1.3385 -1.0195 -1.0195 -0.9786 -0.9786 -0.5943 -0.5943 -0.5928 -0.5928 0.2117 0.2117 0.2498 0.2498 0.3810 0.3810 0.4082 0.4082 0.7135 0.7135 0.7918 0.7918 0.9868 0.9868 1.0366 1.0366 1.4940 1.4940 1.5329 1.5329 2.0450 2.0450 2.0571 2.0571 2.4311 2.4311 2.4579 2.4579 3.7090 3.7090 3.7174 3.7174 12.3164 12.3164 12.3232 12.3232 14.4379 14.4379 14.4657 14.4657 17.4313 17.4313 k = 0.0000 0.5000 0.6476 ( 2798 PWs) bands (ev): -17.4836 -17.4836 -17.4814 -17.4814 -17.3070 -17.3070 -17.3066 -17.3066 -1.3700 -1.3700 -1.3531 -1.3531 -1.0173 -1.0173 -0.9779 -0.9779 -0.5795 -0.5795 -0.5791 -0.5791 0.2185 0.2185 0.2637 0.2637 0.3913 0.3913 0.4102 0.4102 0.7125 0.7125 0.7845 0.7845 0.9694 0.9694 1.0227 1.0227 1.4789 1.4789 1.5161 1.5161 2.0340 2.0340 2.0469 2.0469 2.4352 2.4352 2.4624 2.4624 3.7149 3.7149 3.7233 3.7233 12.3741 12.3741 12.3819 12.3819 14.3787 14.3787 14.4087 14.4087 17.4816 17.4816 k = 0.0000 0.5000 0.6623 ( 2800 PWs) bands (ev): -17.4784 -17.4784 -17.4762 -17.4762 -17.3095 -17.3095 -17.3092 -17.3092 -1.3825 -1.3825 -1.3660 -1.3660 -1.0150 -1.0150 -0.9769 -0.9769 -0.5677 -0.5677 -0.5656 -0.5656 0.2234 0.2234 0.2762 0.2762 0.4025 0.4025 0.4122 0.4122 0.7113 0.7113 0.7767 0.7767 0.9538 0.9538 1.0105 1.0105 1.4657 1.4657 1.5012 1.5012 2.0244 2.0244 2.0380 2.0380 2.4388 2.4388 2.4662 2.4662 3.7200 3.7200 3.7285 3.7285 12.4271 12.4271 12.4359 12.4359 14.3239 14.3239 14.3559 14.3559 17.5281 17.5281 k = 0.0000 0.5000 0.6771 ( 2804 PWs) bands (ev): -17.4739 -17.4739 -17.4716 -17.4716 -17.3118 -17.3118 -17.3116 -17.3116 -1.3932 -1.3932 -1.3772 -1.3772 -1.0128 -1.0128 -0.9758 -0.9758 -0.5576 -0.5576 -0.5540 -0.5540 0.2267 0.2267 0.2870 0.2870 0.4139 0.4139 0.4141 0.4141 0.7101 0.7101 0.7687 0.7687 0.9403 0.9403 1.0000 1.0000 1.4545 1.4545 1.4882 1.4882 2.0163 2.0163 2.0304 2.0304 2.4418 2.4418 2.4696 2.4696 3.7244 3.7244 3.7329 3.7329 12.4745 12.4745 12.4844 12.4844 14.2747 14.2747 14.3085 14.3085 17.5698 17.5699 k = 0.0000 0.5000 0.6918 ( 2794 PWs) bands (ev): -17.4700 -17.4700 -17.4676 -17.4676 -17.3138 -17.3138 -17.3137 -17.3137 -1.4021 -1.4021 -1.3865 -1.3865 -1.0108 -1.0108 -0.9747 -0.9747 -0.5491 -0.5491 -0.5442 -0.5442 0.2290 0.2290 0.2960 0.2960 0.4161 0.4161 0.4250 0.4250 0.7088 0.7088 0.7610 0.7610 0.9293 0.9293 0.9916 0.9916 1.4454 1.4454 1.4774 1.4774 2.0096 2.0096 2.0242 2.0242 2.4444 2.4444 2.4723 2.4723 3.7280 3.7280 3.7366 3.7366 12.5153 12.5153 12.5262 12.5262 14.2320 14.2320 14.2676 14.2676 17.6061 17.6061 k = 0.0000 0.5000 0.7065 ( 2786 PWs) bands (ev): -17.4669 -17.4669 -17.4644 -17.4644 -17.3155 -17.3155 -17.3154 -17.3154 -1.4091 -1.4091 -1.3938 -1.3938 -1.0091 -1.0091 -0.9737 -0.9737 -0.5424 -0.5424 -0.5365 -0.5365 0.2303 0.2303 0.3031 0.3031 0.4178 0.4178 0.4347 0.4347 0.7076 0.7076 0.7541 0.7541 0.9206 0.9206 0.9849 0.9849 1.4384 1.4384 1.4690 1.4690 2.0043 2.0043 2.0194 2.0194 2.4463 2.4463 2.4744 2.4744 3.7308 3.7308 3.7394 3.7394 12.5485 12.5485 12.5602 12.5602 14.1973 14.1973 14.2342 14.2342 17.6357 17.6357 k = 0.0000 0.5000 0.7212 ( 2798 PWs) bands (ev): -17.4647 -17.4647 -17.4621 -17.4621 -17.3167 -17.3167 -17.3167 -17.3167 -1.4142 -1.4142 -1.3991 -1.3991 -1.0079 -1.0079 -0.9731 -0.9731 -0.5377 -0.5377 -0.5310 -0.5310 0.2310 0.2310 0.3081 0.3081 0.4193 0.4193 0.4424 0.4424 0.7065 0.7065 0.7484 0.7484 0.9141 0.9141 0.9800 0.9800 1.4332 1.4332 1.4627 1.4627 2.0005 2.0005 2.0159 2.0159 2.4477 2.4477 2.4759 2.4759 3.7328 3.7328 3.7414 3.7414 12.5730 12.5730 12.5855 12.5855 14.1714 14.1714 14.2095 14.2095 17.6578 17.6578 k = 0.0000 0.5000 0.7359 ( 2804 PWs) bands (ev): -17.4633 -17.4633 -17.4607 -17.4607 -17.3175 -17.3175 -17.3175 -17.3175 -1.4172 -1.4172 -1.4023 -1.4023 -1.0072 -1.0072 -0.9727 -0.9727 -0.5348 -0.5348 -0.5276 -0.5276 0.2313 0.2313 0.3110 0.3110 0.4202 0.4202 0.4474 0.4474 0.7058 0.7058 0.7447 0.7447 0.9103 0.9103 0.9771 0.9771 1.4302 1.4302 1.4590 1.4590 1.9982 1.9982 2.0138 2.0138 2.4485 2.4485 2.4768 2.4768 3.7340 3.7340 3.7426 3.7426 12.5881 12.5881 12.6011 12.6011 14.1555 14.1555 14.1942 14.1942 17.6714 17.6714 k = 0.0000 0.5000 0.7507 ( 2804 PWs) bands (ev): -17.4628 -17.4628 -17.4603 -17.4603 -17.3177 -17.3177 -17.3177 -17.3177 -1.4182 -1.4182 -1.4033 -1.4033 -1.0070 -1.0070 -0.9725 -0.9725 -0.5338 -0.5338 -0.5265 -0.5265 0.2314 0.2314 0.3120 0.3120 0.4206 0.4206 0.4491 0.4491 0.7055 0.7055 0.7434 0.7434 0.9090 0.9090 0.9761 0.9761 1.4291 1.4291 1.4577 1.4577 1.9975 1.9975 2.0131 2.0131 2.4488 2.4488 2.4771 2.4771 3.7344 3.7344 3.7430 3.7430 12.5932 12.5932 12.6063 12.6063 14.1501 14.1501 14.1891 14.1891 17.6760 17.6760 k = 0.5000 0.5000-0.0000 ( 2828 PWs) bands (ev): -17.6453 -17.6453 -17.6453 -17.6453 -17.3553 -17.3553 -17.3553 -17.3553 -1.9868 -1.9868 -1.9868 -1.9868 -0.8105 -0.8105 -0.8105 -0.8105 0.2538 0.2538 0.2538 0.2538 0.4762 0.4762 0.4762 0.4762 0.6904 0.6904 0.6904 0.6904 0.8716 0.8716 0.8716 0.8716 1.1629 1.1629 1.1629 1.1629 1.5747 1.5747 1.5747 1.5747 2.2167 2.2167 2.2167 2.2167 2.5420 2.5420 2.5420 2.5420 3.4179 3.4179 3.4179 3.4179 10.8664 10.8664 10.8664 10.8664 13.0227 13.0227 13.0227 13.0227 18.3757 18.3757 k = 0.5000 0.5000 0.0147 ( 2828 PWs) bands (ev): -17.6451 -17.6451 -17.6451 -17.6451 -17.3553 -17.3553 -17.3553 -17.3553 -1.9864 -1.9864 -1.9864 -1.9864 -0.8112 -0.8112 -0.8112 -0.8112 0.2539 0.2539 0.2539 0.2539 0.4775 0.4775 0.4775 0.4775 0.6896 0.6896 0.6896 0.6896 0.8700 0.8700 0.8700 0.8700 1.1613 1.1613 1.1613 1.1613 1.5749 1.5749 1.5749 1.5749 2.2191 2.2191 2.2191 2.2191 2.5418 2.5418 2.5418 2.5418 3.4171 3.4171 3.4171 3.4171 10.8675 10.8675 10.8675 10.8675 13.0246 13.0246 13.0246 13.0246 18.3754 18.3754 k = 0.5000 0.5000 0.0294 ( 2820 PWs) bands (ev): -17.6447 -17.6447 -17.6447 -17.6447 -17.3551 -17.3551 -17.3551 -17.3551 -1.9852 -1.9852 -1.9852 -1.9852 -0.8133 -0.8133 -0.8133 -0.8133 0.2543 0.2543 0.2543 0.2543 0.4814 0.4814 0.4814 0.4814 0.6874 0.6874 0.6874 0.6874 0.8653 0.8653 0.8653 0.8653 1.1566 1.1566 1.1566 1.1566 1.5754 1.5754 1.5754 1.5754 2.2261 2.2261 2.2261 2.2261 2.5414 2.5414 2.5414 2.5414 3.4148 3.4148 3.4148 3.4148 10.8709 10.8709 10.8709 10.8709 13.0300 13.0300 13.0300 13.0300 18.3743 18.3743 k = 0.5000 0.5000 0.0442 ( 2820 PWs) bands (ev): -17.6439 -17.6439 -17.6439 -17.6439 -17.3549 -17.3549 -17.3549 -17.3549 -1.9833 -1.9833 -1.9833 -1.9833 -0.8168 -0.8168 -0.8168 -0.8168 0.2550 0.2550 0.2550 0.2550 0.4878 0.4878 0.4878 0.4878 0.6835 0.6835 0.6835 0.6835 0.8575 0.8575 0.8575 0.8575 1.1492 1.1492 1.1492 1.1492 1.5761 1.5761 1.5761 1.5761 2.2374 2.2374 2.2374 2.2374 2.5406 2.5406 2.5406 2.5406 3.4108 3.4108 3.4108 3.4108 10.8765 10.8765 10.8765 10.8765 13.0391 13.0391 13.0391 13.0391 18.3724 18.3724 k = 0.5000 0.5000 0.0589 ( 2828 PWs) bands (ev): -17.6428 -17.6428 -17.6428 -17.6428 -17.3545 -17.3545 -17.3545 -17.3545 -1.9806 -1.9806 -1.9806 -1.9806 -0.8217 -0.8217 -0.8217 -0.8217 0.2559 0.2559 0.2559 0.2559 0.4963 0.4963 0.4963 0.4963 0.6780 0.6780 0.6780 0.6780 0.8466 0.8466 0.8466 0.8466 1.1395 1.1395 1.1395 1.1395 1.5773 1.5773 1.5773 1.5773 2.2527 2.2527 2.2527 2.2527 2.5395 2.5395 2.5395 2.5395 3.4052 3.4052 3.4052 3.4052 10.8843 10.8843 10.8843 10.8843 13.0517 13.0517 13.0517 13.0517 18.3697 18.3697 k = 0.5000 0.5000 0.0736 ( 2828 PWs) bands (ev): -17.6414 -17.6414 -17.6414 -17.6414 -17.3540 -17.3540 -17.3540 -17.3540 -1.9772 -1.9772 -1.9772 -1.9772 -0.8278 -0.8278 -0.8278 -0.8278 0.2570 0.2570 0.2570 0.2570 0.5069 0.5069 0.5069 0.5069 0.6706 0.6706 0.6706 0.6706 0.8331 0.8331 0.8331 0.8331 1.1283 1.1283 1.1283 1.1283 1.5787 1.5787 1.5787 1.5787 2.2713 2.2713 2.2713 2.2713 2.5382 2.5382 2.5382 2.5382 3.3981 3.3981 3.3981 3.3981 10.8943 10.8943 10.8943 10.8943 13.0679 13.0679 13.0679 13.0679 18.3661 18.3661 k = 0.5000 0.5000 0.0883 ( 2820 PWs) bands (ev): -17.6397 -17.6397 -17.6397 -17.6397 -17.3534 -17.3534 -17.3534 -17.3534 -1.9730 -1.9730 -1.9730 -1.9730 -0.8349 -0.8349 -0.8349 -0.8349 0.2584 0.2584 0.2584 0.2584 0.5189 0.5189 0.5189 0.5189 0.6615 0.6615 0.6615 0.6615 0.8173 0.8173 0.8173 0.8173 1.1161 1.1161 1.1161 1.1161 1.5805 1.5805 1.5805 1.5805 2.2928 2.2928 2.2928 2.2928 2.5366 2.5366 2.5366 2.5366 3.3897 3.3897 3.3897 3.3897 10.9064 10.9064 10.9064 10.9064 13.0876 13.0876 13.0876 13.0876 18.3615 18.3615 k = 0.5000 0.5000 0.1030 ( 2812 PWs) bands (ev): -17.6377 -17.6377 -17.6377 -17.6377 -17.3528 -17.3528 -17.3528 -17.3528 -1.9681 -1.9681 -1.9681 -1.9681 -0.8430 -0.8430 -0.8430 -0.8430 0.2600 0.2600 0.2600 0.2600 0.5314 0.5314 0.5314 0.5314 0.6505 0.6505 0.6505 0.6505 0.8000 0.8000 0.8000 0.8000 1.1036 1.1036 1.1036 1.1036 1.5827 1.5827 1.5827 1.5827 2.3166 2.3166 2.3166 2.3166 2.5350 2.5350 2.5350 2.5350 3.3798 3.3798 3.3798 3.3798 10.9206 10.9206 10.9206 10.9206 13.1106 13.1106 13.1106 13.1106 18.3558 18.3558 k = 0.5000 0.5000 0.1177 ( 2812 PWs) bands (ev): -17.6354 -17.6354 -17.6354 -17.6354 -17.3520 -17.3520 -17.3520 -17.3520 -1.9625 -1.9625 -1.9625 -1.9625 -0.8520 -0.8520 -0.8520 -0.8520 0.2615 0.2615 0.2615 0.2615 0.5429 0.5429 0.5429 0.5429 0.6382 0.6382 0.6382 0.6382 0.7824 0.7824 0.7824 0.7824 1.0911 1.0911 1.0911 1.0911 1.5851 1.5851 1.5851 1.5851 2.3419 2.3419 2.3419 2.3419 2.5332 2.5332 2.5332 2.5332 3.3686 3.3686 3.3686 3.3686 10.9367 10.9367 10.9367 10.9367 13.1369 13.1369 13.1369 13.1369 18.3488 18.3488 k = 0.5000 0.5000 0.1325 ( 2796 PWs) bands (ev): -17.6328 -17.6328 -17.6328 -17.6328 -17.3511 -17.3511 -17.3511 -17.3511 -1.9562 -1.9562 -1.9562 -1.9562 -0.8616 -0.8616 -0.8616 -0.8616 0.2629 0.2629 0.2629 0.2629 0.5498 0.5498 0.5498 0.5498 0.6267 0.6267 0.6267 0.6267 0.7662 0.7662 0.7662 0.7662 1.0791 1.0791 1.0791 1.0791 1.5878 1.5878 1.5878 1.5878 2.3683 2.3683 2.3683 2.3683 2.5314 2.5314 2.5314 2.5314 3.3562 3.3562 3.3562 3.3562 10.9548 10.9548 10.9548 10.9548 13.1664 13.1664 13.1664 13.1664 18.3404 18.3404 k = 0.5000 0.5000 0.1472 ( 2788 PWs) bands (ev): -17.6300 -17.6300 -17.6300 -17.6300 -17.3502 -17.3502 -17.3502 -17.3502 -1.9493 -1.9493 -1.9493 -1.9493 -0.8717 -0.8717 -0.8717 -0.8717 0.2641 0.2641 0.2641 0.2641 0.5464 0.5464 0.5464 0.5464 0.6197 0.6197 0.6197 0.6197 0.7534 0.7534 0.7534 0.7534 1.0678 1.0678 1.0678 1.0678 1.5908 1.5908 1.5908 1.5908 2.3950 2.3950 2.3950 2.3950 2.5301 2.5301 2.5301 2.5301 3.3426 3.3426 3.3426 3.3426 10.9747 10.9747 10.9747 10.9747 13.1990 13.1990 13.1990 13.1990 18.3305 18.3305 k = 0.5000 0.5000 0.1619 ( 2788 PWs) bands (ev): -17.6268 -17.6268 -17.6268 -17.6268 -17.3491 -17.3491 -17.3491 -17.3491 -1.9418 -1.9418 -1.9418 -1.9418 -0.8823 -0.8823 -0.8823 -0.8823 0.2646 0.2646 0.2646 0.2646 0.5303 0.5303 0.5303 0.5303 0.6177 0.6177 0.6177 0.6177 0.7466 0.7466 0.7466 0.7466 1.0571 1.0571 1.0571 1.0571 1.5940 1.5940 1.5940 1.5940 2.4210 2.4210 2.4210 2.4210 2.5297 2.5297 2.5297 2.5297 3.3279 3.3279 3.3279 3.3279 10.9963 10.9963 10.9963 10.9963 13.2346 13.2346 13.2346 13.2346 18.3187 18.3187 k = 0.5000 0.5000 0.1766 ( 2788 PWs) bands (ev): -17.6235 -17.6235 -17.6235 -17.6235 -17.3480 -17.3480 -17.3480 -17.3480 -1.9337 -1.9337 -1.9337 -1.9337 -0.8932 -0.8932 -0.8932 -0.8932 0.2639 0.2639 0.2639 0.2639 0.5054 0.5054 0.5054 0.5054 0.6151 0.6151 0.6151 0.6151 0.7484 0.7484 0.7484 0.7484 1.0473 1.0473 1.0473 1.0473 1.5973 1.5973 1.5973 1.5973 2.4447 2.4447 2.4447 2.4447 2.5315 2.5315 2.5315 2.5315 3.3123 3.3123 3.3123 3.3123 11.0195 11.0195 11.0195 11.0195 13.2729 13.2729 13.2729 13.2729 18.3049 18.3049 k = 0.5000 0.5000 0.1913 ( 2788 PWs) bands (ev): -17.6199 -17.6199 -17.6199 -17.6199 -17.3468 -17.3468 -17.3468 -17.3468 -1.9251 -1.9251 -1.9251 -1.9251 -0.9042 -0.9042 -0.9042 -0.9042 0.2613 0.2613 0.2613 0.2613 0.4761 0.4761 0.4761 0.4761 0.6079 0.6079 0.6079 0.6079 0.7591 0.7591 0.7591 0.7591 1.0383 1.0383 1.0383 1.0383 1.6009 1.6009 1.6009 1.6009 2.4636 2.4636 2.4636 2.4636 2.5379 2.5379 2.5379 2.5379 3.2958 3.2958 3.2958 3.2958 11.0443 11.0443 11.0443 11.0443 13.3140 13.3140 13.3140 13.3140 18.2888 18.2888 k = 0.5000 0.5000 0.2061 ( 2796 PWs) bands (ev): -17.6161 -17.6161 -17.6161 -17.6161 -17.3455 -17.3455 -17.3455 -17.3455 -1.9160 -1.9160 -1.9160 -1.9160 -0.9153 -0.9153 -0.9153 -0.9153 0.2554 0.2554 0.2554 0.2554 0.4461 0.4461 0.4461 0.4461 0.5961 0.5961 0.5961 0.5961 0.7769 0.7769 0.7769 0.7769 1.0301 1.0301 1.0301 1.0301 1.6046 1.6046 1.6046 1.6046 2.4748 2.4748 2.4748 2.4748 2.5514 2.5514 2.5514 2.5514 3.2784 3.2784 3.2784 3.2784 11.0705 11.0705 11.0705 11.0705 13.3576 13.3576 13.3576 13.3576 18.2700 18.2700 k = 0.5000 0.5000 0.2208 ( 2792 PWs) bands (ev): -17.6121 -17.6121 -17.6121 -17.6121 -17.3442 -17.3442 -17.3442 -17.3442 -1.9065 -1.9065 -1.9065 -1.9065 -0.9262 -0.9262 -0.9262 -0.9262 0.2443 0.2443 0.2443 0.2443 0.4185 0.4185 0.4185 0.4185 0.5810 0.5810 0.5810 0.5810 0.7994 0.7994 0.7994 0.7994 1.0227 1.0227 1.0227 1.0227 1.6085 1.6085 1.6085 1.6085 2.4790 2.4790 2.4790 2.4790 2.5714 2.5714 2.5714 2.5714 3.2605 3.2605 3.2605 3.2605 11.0979 11.0979 11.0979 11.0979 13.4037 13.4037 13.4037 13.4037 18.2481 18.2481 k = 0.5000 0.5000 0.2355 ( 2800 PWs) bands (ev): -17.6078 -17.6078 -17.6078 -17.6078 -17.3428 -17.3428 -17.3428 -17.3428 -1.8966 -1.8966 -1.8966 -1.8966 -0.9368 -0.9368 -0.9368 -0.9368 0.2257 0.2257 0.2257 0.2257 0.3962 0.3962 0.3962 0.3962 0.5636 0.5636 0.5636 0.5636 0.8249 0.8249 0.8249 0.8249 1.0159 1.0159 1.0159 1.0159 1.6127 1.6127 1.6127 1.6127 2.4787 2.4787 2.4787 2.4787 2.5948 2.5948 2.5948 2.5948 3.2419 3.2419 3.2419 3.2419 11.1265 11.1265 11.1265 11.1265 13.4520 13.4520 13.4520 13.4520 18.2219 18.2219 k = 0.5000 0.5000 0.2502 ( 2808 PWs) bands (ev): -17.6034 -17.6034 -17.6034 -17.6034 -17.3413 -17.3413 -17.3413 -17.3413 -1.8863 -1.8863 -1.8863 -1.8863 -0.9472 -0.9472 -0.9472 -0.9472 0.1989 0.1989 0.1989 0.1989 0.3804 0.3804 0.3804 0.3804 0.5448 0.5448 0.5448 0.5448 0.8520 0.8520 0.8520 0.8520 1.0100 1.0100 1.0100 1.0100 1.6172 1.6172 1.6172 1.6172 2.4761 2.4761 2.4761 2.4761 2.6198 2.6198 2.6198 2.6198 3.2229 3.2229 3.2229 3.2229 11.1561 11.1561 11.1561 11.1561 13.5024 13.5024 13.5024 13.5024 18.1890 18.1890 k = 0.5000 0.5000 0.2649 ( 2808 PWs) bands (ev): -17.5988 -17.5988 -17.5988 -17.5988 -17.3398 -17.3398 -17.3398 -17.3398 -1.8758 -1.8758 -1.8758 -1.8758 -0.9571 -0.9571 -0.9571 -0.9571 0.1649 0.1649 0.1649 0.1649 0.3707 0.3707 0.3707 0.3707 0.5251 0.5251 0.5251 0.5251 0.8800 0.8800 0.8800 0.8800 1.0050 1.0050 1.0050 1.0050 1.6220 1.6220 1.6220 1.6220 2.4721 2.4721 2.4721 2.4721 2.6451 2.6451 2.6451 2.6451 3.2035 3.2035 3.2035 3.2035 11.1866 11.1866 11.1866 11.1866 13.5548 13.5548 13.5548 13.5548 18.1414 18.1414 k = 0.5000 0.5000 0.2797 ( 2808 PWs) bands (ev): -17.5941 -17.5941 -17.5941 -17.5941 -17.3382 -17.3382 -17.3382 -17.3382 -1.8651 -1.8651 -1.8651 -1.8651 -0.9665 -0.9665 -0.9665 -0.9665 0.1259 0.1259 0.1259 0.1259 0.3648 0.3648 0.3648 0.3648 0.5052 0.5052 0.5052 0.5052 0.9078 0.9078 0.9078 0.9078 1.0013 1.0013 1.0013 1.0013 1.6273 1.6273 1.6273 1.6273 2.4674 2.4674 2.4674 2.4674 2.6701 2.6701 2.6701 2.6701 3.1837 3.1837 3.1837 3.1837 11.2178 11.2178 11.2178 11.2178 13.6090 13.6090 13.6090 13.6090 18.0638 18.0638 k = 0.5000 0.5000 0.2944 ( 2804 PWs) bands (ev): -17.5893 -17.5893 -17.5893 -17.5893 -17.3366 -17.3366 -17.3366 -17.3366 -1.8542 -1.8542 -1.8542 -1.8542 -0.9753 -0.9753 -0.9753 -0.9753 0.0838 0.0838 0.0838 0.0838 0.3605 0.3605 0.3605 0.3605 0.4858 0.4858 0.4858 0.4858 0.9339 0.9339 0.9339 0.9339 0.9999 0.9999 0.9999 0.9999 1.6332 1.6332 1.6332 1.6332 2.4621 2.4621 2.4621 2.4621 2.6945 2.6945 2.6945 2.6945 3.1637 3.1637 3.1637 3.1637 11.2496 11.2496 11.2496 11.2496 13.6649 13.6649 13.6649 13.6649 17.9621 17.9621 k = 0.5000 0.5000 0.3091 ( 2804 PWs) bands (ev): -17.5843 -17.5843 -17.5843 -17.5843 -17.3350 -17.3350 -17.3350 -17.3350 -1.8433 -1.8433 -1.8433 -1.8433 -0.9835 -0.9835 -0.9835 -0.9835 0.0399 0.0399 0.0399 0.0399 0.3556 0.3556 0.3556 0.3556 0.4680 0.4680 0.4680 0.4680 0.9548 0.9548 0.9548 0.9548 1.0040 1.0040 1.0040 1.0040 1.6398 1.6398 1.6398 1.6398 2.4563 2.4563 2.4563 2.4563 2.7181 2.7181 2.7181 2.7181 3.1435 3.1435 3.1435 3.1435 11.2819 11.2819 11.2819 11.2819 13.7223 13.7223 13.7223 13.7223 17.8534 17.8534 k = 0.5000 0.5000 0.3238 ( 2816 PWs) bands (ev): -17.5792 -17.5792 -17.5792 -17.5792 -17.3333 -17.3333 -17.3333 -17.3333 -1.8324 -1.8324 -1.8324 -1.8324 -0.9910 -0.9910 -0.9910 -0.9910 -0.0049 -0.0049 -0.0049 -0.0049 0.3478 0.3478 0.3478 0.3478 0.4534 0.4534 0.4534 0.4534 0.9653 0.9653 0.9653 0.9653 1.0183 1.0183 1.0183 1.0183 1.6473 1.6473 1.6473 1.6473 2.4502 2.4502 2.4502 2.4502 2.7408 2.7408 2.7408 2.7408 3.1230 3.1230 3.1230 3.1230 11.3145 11.3145 11.3145 11.3145 13.7811 13.7811 13.7811 13.7811 17.7443 17.7443 k = 0.5000 0.5000 0.3385 ( 2816 PWs) bands (ev): -17.5741 -17.5741 -17.5741 -17.5741 -17.3316 -17.3316 -17.3316 -17.3316 -1.8215 -1.8215 -1.8215 -1.8215 -0.9977 -0.9977 -0.9977 -0.9977 -0.0497 -0.0497 -0.0497 -0.0497 0.3355 0.3355 0.3355 0.3355 0.4436 0.4436 0.4436 0.4436 0.9674 0.9674 0.9674 0.9674 1.0405 1.0405 1.0405 1.0405 1.6559 1.6559 1.6559 1.6559 2.4439 2.4439 2.4439 2.4439 2.7626 2.7626 2.7626 2.7626 3.1026 3.1026 3.1026 3.1026 11.3473 11.3473 11.3473 11.3473 13.8411 13.8411 13.8411 13.8411 17.6368 17.6368 k = 0.5000 0.5000 0.3532 ( 2804 PWs) bands (ev): -17.5689 -17.5689 -17.5689 -17.5689 -17.3299 -17.3299 -17.3299 -17.3299 -1.8107 -1.8107 -1.8107 -1.8107 -1.0036 -1.0036 -1.0036 -1.0036 -0.0942 -0.0942 -0.0942 -0.0942 0.3181 0.3181 0.3181 0.3181 0.4389 0.4389 0.4389 0.4389 0.9665 0.9665 0.9665 0.9665 1.0651 1.0651 1.0651 1.0651 1.6658 1.6658 1.6658 1.6658 2.4373 2.4373 2.4373 2.4373 2.7834 2.7834 2.7834 2.7834 3.0821 3.0821 3.0821 3.0821 11.3801 11.3801 11.3801 11.3801 13.9022 13.9022 13.9022 13.9022 17.5318 17.5318 k = 0.5000 0.5000 0.3680 ( 2796 PWs) bands (ev): -17.5636 -17.5636 -17.5636 -17.5636 -17.3281 -17.3281 -17.3281 -17.3281 -1.8001 -1.8001 -1.8001 -1.8001 -1.0086 -1.0086 -1.0086 -1.0086 -0.1380 -0.1380 -0.1380 -0.1380 0.2965 0.2965 0.2965 0.2965 0.4383 0.4383 0.4383 0.4383 0.9644 0.9644 0.9644 0.9644 1.0896 1.0896 1.0896 1.0896 1.6771 1.6771 1.6771 1.6771 2.4306 2.4306 2.4306 2.4306 2.8031 2.8031 2.8031 2.8031 3.0617 3.0617 3.0617 3.0617 11.4128 11.4128 11.4128 11.4128 13.9643 13.9643 13.9643 13.9643 17.4296 17.4296 k = 0.5000 0.5000 0.3827 ( 2796 PWs) bands (ev): -17.5584 -17.5584 -17.5584 -17.5584 -17.3264 -17.3264 -17.3264 -17.3264 -1.7899 -1.7899 -1.7899 -1.7899 -1.0128 -1.0128 -1.0128 -1.0128 -0.1809 -0.1809 -0.1809 -0.1809 0.2716 0.2716 0.2716 0.2716 0.4405 0.4405 0.4405 0.4405 0.9619 0.9619 0.9619 0.9619 1.1130 1.1130 1.1130 1.1130 1.6900 1.6900 1.6900 1.6900 2.4238 2.4238 2.4238 2.4238 2.8217 2.8217 2.8217 2.8217 3.0412 3.0412 3.0412 3.0412 11.4452 11.4452 11.4452 11.4452 14.0272 14.0272 14.0272 14.0272 17.3305 17.3305 k = 0.5000 0.5000 0.3974 ( 2804 PWs) bands (ev): -17.5531 -17.5531 -17.5531 -17.5531 -17.3247 -17.3247 -17.3247 -17.3247 -1.7801 -1.7801 -1.7801 -1.7801 -1.0161 -1.0161 -1.0161 -1.0161 -0.2225 -0.2225 -0.2225 -0.2225 0.2445 0.2445 0.2445 0.2445 0.4445 0.4445 0.4445 0.4445 0.9592 0.9592 0.9592 0.9592 1.1348 1.1348 1.1348 1.1348 1.7048 1.7048 1.7048 1.7048 2.4169 2.4169 2.4169 2.4169 2.8392 2.8392 2.8392 2.8392 3.0208 3.0208 3.0208 3.0208 11.4773 11.4773 11.4773 11.4773 14.0908 14.0908 14.0908 14.0908 17.2347 17.2347 k = 0.5000 0.5000 0.4121 ( 2796 PWs) bands (ev): -17.5479 -17.5479 -17.5479 -17.5479 -17.3230 -17.3230 -17.3230 -17.3230 -1.7706 -1.7706 -1.7706 -1.7706 -1.0185 -1.0185 -1.0185 -1.0185 -0.2628 -0.2628 -0.2628 -0.2628 0.2161 0.2161 0.2161 0.2161 0.4498 0.4498 0.4498 0.4498 0.9567 0.9567 0.9567 0.9567 1.1548 1.1548 1.1548 1.1548 1.7215 1.7215 1.7215 1.7215 2.4099 2.4099 2.4099 2.4099 2.8555 2.8555 2.8555 2.8555 3.0005 3.0005 3.0005 3.0005 11.5089 11.5089 11.5089 11.5089 14.1550 14.1550 14.1550 14.1550 17.1423 17.1423 k = 0.5000 0.5000 0.4268 ( 2796 PWs) bands (ev): -17.5427 -17.5427 -17.5427 -17.5427 -17.3213 -17.3213 -17.3213 -17.3213 -1.7617 -1.7617 -1.7617 -1.7617 -1.0199 -1.0199 -1.0199 -1.0199 -0.3014 -0.3014 -0.3014 -0.3014 0.1866 0.1866 0.1866 0.1866 0.4559 0.4559 0.4559 0.4559 0.9540 0.9540 0.9540 0.9540 1.1728 1.1728 1.1728 1.1728 1.7402 1.7402 1.7402 1.7402 2.4029 2.4029 2.4029 2.4029 2.8705 2.8705 2.8705 2.8705 2.9805 2.9805 2.9805 2.9805 11.5398 11.5398 11.5398 11.5398 14.2196 14.2196 14.2196 14.2196 17.0534 17.0534 k = 0.5000 0.5000 0.4416 ( 2804 PWs) bands (ev): -17.5376 -17.5376 -17.5376 -17.5376 -17.3196 -17.3196 -17.3196 -17.3196 -1.7534 -1.7534 -1.7534 -1.7534 -1.0204 -1.0204 -1.0204 -1.0204 -0.3384 -0.3384 -0.3384 -0.3384 0.1563 0.1563 0.1563 0.1563 0.4624 0.4624 0.4624 0.4624 0.9514 0.9514 0.9514 0.9514 1.1886 1.1886 1.1886 1.1886 1.7608 1.7608 1.7608 1.7608 2.3959 2.3959 2.3959 2.3959 2.8838 2.8838 2.8838 2.8838 2.9611 2.9611 2.9611 2.9611 11.5701 11.5701 11.5701 11.5701 14.2846 14.2846 14.2846 14.2846 16.9682 16.9682 k = 0.5000 0.5000 0.4563 ( 2796 PWs) bands (ev): -17.5325 -17.5325 -17.5325 -17.5325 -17.3179 -17.3179 -17.3179 -17.3179 -1.7457 -1.7457 -1.7457 -1.7457 -1.0199 -1.0199 -1.0199 -1.0199 -0.3735 -0.3735 -0.3735 -0.3735 0.1258 0.1258 0.1258 0.1258 0.4693 0.4693 0.4693 0.4693 0.9489 0.9489 0.9489 0.9489 1.2024 1.2024 1.2024 1.2024 1.7835 1.7835 1.7835 1.7835 2.3889 2.3889 2.3889 2.3889 2.8942 2.8942 2.8942 2.8942 2.9436 2.9436 2.9436 2.9436 11.5994 11.5994 11.5994 11.5994 14.3498 14.3498 14.3498 14.3498 16.8866 16.8866 k = 0.5000 0.5000 0.4710 ( 2796 PWs) bands (ev): -17.5276 -17.5276 -17.5276 -17.5276 -17.3163 -17.3163 -17.3163 -17.3163 -1.7387 -1.7387 -1.7387 -1.7387 -1.0186 -1.0186 -1.0186 -1.0186 -0.4066 -0.4066 -0.4066 -0.4066 0.0948 0.0948 0.0948 0.0948 0.4763 0.4763 0.4763 0.4763 0.9465 0.9465 0.9465 0.9465 1.2141 1.2141 1.2141 1.2141 1.8079 1.8079 1.8079 1.8079 2.3820 2.3820 2.3820 2.3820 2.8968 2.8968 2.8968 2.8968 2.9329 2.9329 2.9329 2.9329 11.6279 11.6279 11.6279 11.6279 14.4152 14.4152 14.4152 14.4152 16.8088 16.8088 k = 0.5000 0.5000 0.4857 ( 2796 PWs) bands (ev): -17.5228 -17.5228 -17.5228 -17.5228 -17.3147 -17.3147 -17.3147 -17.3147 -1.7324 -1.7324 -1.7324 -1.7324 -1.0163 -1.0163 -1.0163 -1.0163 -0.4378 -0.4378 -0.4378 -0.4378 0.0637 0.0637 0.0637 0.0637 0.4834 0.4834 0.4834 0.4834 0.9442 0.9442 0.9442 0.9442 1.2239 1.2239 1.2239 1.2239 1.8340 1.8340 1.8340 1.8340 2.3752 2.3752 2.3752 2.3752 2.8858 2.8858 2.8858 2.8858 2.9348 2.9348 2.9348 2.9348 11.6552 11.6552 11.6552 11.6552 14.4805 14.4805 14.4805 14.4805 16.7349 16.7349 k = 0.5000 0.5000 0.5004 ( 2796 PWs) bands (ev): -17.5181 -17.5181 -17.5181 -17.5181 -17.3132 -17.3132 -17.3132 -17.3132 -1.7268 -1.7268 -1.7268 -1.7268 -1.0131 -1.0131 -1.0131 -1.0131 -0.4668 -0.4668 -0.4668 -0.4668 0.0326 0.0326 0.0326 0.0326 0.4905 0.4905 0.4905 0.4905 0.9419 0.9419 0.9419 0.9419 1.2321 1.2321 1.2321 1.2321 1.8615 1.8615 1.8615 1.8615 2.3686 2.3686 2.3686 2.3686 2.8680 2.8680 2.8680 2.8680 2.9425 2.9425 2.9425 2.9425 11.6815 11.6815 11.6815 11.6815 14.5457 14.5457 14.5457 14.5457 16.6648 16.6648 k = 0.5000 0.5000 0.5152 ( 2796 PWs) bands (ev): -17.5135 -17.5135 -17.5135 -17.5135 -17.3117 -17.3117 -17.3117 -17.3117 -1.7220 -1.7220 -1.7220 -1.7220 -1.0091 -1.0091 -1.0091 -1.0091 -0.4938 -0.4938 -0.4938 -0.4938 0.0017 0.0017 0.0017 0.0017 0.4975 0.4975 0.4975 0.4975 0.9397 0.9397 0.9397 0.9397 1.2386 1.2386 1.2386 1.2386 1.8902 1.8902 1.8902 1.8902 2.3621 2.3621 2.3621 2.3621 2.8481 2.8481 2.8481 2.8481 2.9512 2.9512 2.9512 2.9512 11.7065 11.7065 11.7065 11.7065 14.6106 14.6106 14.6106 14.6106 16.5987 16.5987 k = 0.5000 0.5000 0.5299 ( 2800 PWs) bands (ev): -17.5092 -17.5092 -17.5092 -17.5092 -17.3103 -17.3103 -17.3103 -17.3103 -1.7180 -1.7180 -1.7180 -1.7180 -1.0043 -1.0043 -1.0043 -1.0043 -0.5186 -0.5186 -0.5186 -0.5186 -0.0289 -0.0289 -0.0289 -0.0289 0.5044 0.5044 0.5044 0.5044 0.9375 0.9375 0.9375 0.9375 1.2439 1.2439 1.2439 1.2439 1.9199 1.9199 1.9199 1.9199 2.3558 2.3558 2.3558 2.3558 2.8274 2.8274 2.8274 2.8274 2.9598 2.9598 2.9598 2.9598 11.7303 11.7303 11.7303 11.7303 14.6751 14.6751 14.6751 14.6751 16.5365 16.5365 k = 0.5000 0.5000 0.5446 ( 2800 PWs) bands (ev): -17.5050 -17.5050 -17.5050 -17.5050 -17.3089 -17.3089 -17.3089 -17.3089 -1.7147 -1.7147 -1.7147 -1.7147 -0.9988 -0.9988 -0.9988 -0.9988 -0.5413 -0.5413 -0.5413 -0.5413 -0.0590 -0.0590 -0.0590 -0.0590 0.5111 0.5111 0.5111 0.5111 0.9355 0.9355 0.9355 0.9355 1.2479 1.2479 1.2479 1.2479 1.9504 1.9504 1.9504 1.9504 2.3497 2.3497 2.3497 2.3497 2.8062 2.8062 2.8062 2.8062 2.9678 2.9678 2.9678 2.9678 11.7527 11.7527 11.7527 11.7527 14.7390 14.7390 14.7390 14.7390 16.4783 16.4783 k = 0.5000 0.5000 0.5593 ( 2804 PWs) bands (ev): -17.5011 -17.5011 -17.5011 -17.5011 -17.3076 -17.3076 -17.3076 -17.3076 -1.7121 -1.7121 -1.7121 -1.7121 -0.9926 -0.9926 -0.9926 -0.9926 -0.5620 -0.5620 -0.5620 -0.5620 -0.0884 -0.0884 -0.0884 -0.0884 0.5176 0.5176 0.5176 0.5176 0.9335 0.9335 0.9335 0.9335 1.2510 1.2510 1.2510 1.2510 1.9815 1.9815 1.9815 1.9815 2.3439 2.3439 2.3439 2.3439 2.7847 2.7847 2.7847 2.7847 2.9752 2.9752 2.9752 2.9752 11.7738 11.7738 11.7738 11.7738 14.8022 14.8022 14.8022 14.8022 16.4242 16.4242 k = 0.5000 0.5000 0.5740 ( 2796 PWs) bands (ev): -17.4974 -17.4974 -17.4974 -17.4974 -17.3064 -17.3064 -17.3064 -17.3064 -1.7101 -1.7101 -1.7101 -1.7101 -0.9858 -0.9858 -0.9858 -0.9858 -0.5805 -0.5805 -0.5805 -0.5805 -0.1171 -0.1171 -0.1171 -0.1171 0.5238 0.5238 0.5238 0.5238 0.9319 0.9319 0.9319 0.9319 1.2533 1.2533 1.2533 1.2533 2.0129 2.0129 2.0129 2.0129 2.3383 2.3383 2.3383 2.3383 2.7630 2.7630 2.7630 2.7630 2.9821 2.9821 2.9821 2.9821 11.7934 11.7934 11.7934 11.7934 14.8644 14.8644 14.8644 14.8644 16.3740 16.3740 k = 0.5000 0.5000 0.5887 ( 2796 PWs) bands (ev): -17.4939 -17.4939 -17.4939 -17.4939 -17.3053 -17.3053 -17.3053 -17.3053 -1.7087 -1.7087 -1.7087 -1.7087 -0.9785 -0.9785 -0.9785 -0.9785 -0.5971 -0.5971 -0.5971 -0.5971 -0.1448 -0.1448 -0.1448 -0.1448 0.5296 0.5296 0.5296 0.5296 0.9301 0.9301 0.9301 0.9301 1.2549 1.2549 1.2549 1.2549 2.0443 2.0443 2.0443 2.0443 2.3331 2.3331 2.3331 2.3331 2.7410 2.7410 2.7410 2.7410 2.9882 2.9882 2.9882 2.9882 11.8115 11.8115 11.8115 11.8115 14.9254 14.9254 14.9254 14.9254 16.3279 16.3279 k = 0.5000 0.5000 0.6035 ( 2788 PWs) bands (ev): -17.4906 -17.4906 -17.4906 -17.4906 -17.3042 -17.3042 -17.3042 -17.3042 -1.7079 -1.7079 -1.7079 -1.7079 -0.9708 -0.9708 -0.9708 -0.9708 -0.6118 -0.6118 -0.6118 -0.6118 -0.1712 -0.1712 -0.1712 -0.1712 0.5352 0.5352 0.5352 0.5352 0.9285 0.9285 0.9285 0.9285 1.2561 1.2561 1.2561 1.2561 2.0758 2.0758 2.0758 2.0758 2.3283 2.3283 2.3283 2.3283 2.7188 2.7188 2.7188 2.7188 2.9938 2.9938 2.9938 2.9938 11.8281 11.8281 11.8281 11.8281 14.9848 14.9848 14.9848 14.9848 16.2858 16.2858 k = 0.5000 0.5000 0.6182 ( 2788 PWs) bands (ev): -17.4877 -17.4877 -17.4877 -17.4877 -17.3033 -17.3033 -17.3033 -17.3033 -1.7075 -1.7075 -1.7075 -1.7075 -0.9630 -0.9630 -0.9630 -0.9630 -0.6246 -0.6246 -0.6246 -0.6246 -0.1963 -0.1963 -0.1963 -0.1963 0.5403 0.5403 0.5403 0.5403 0.9270 0.9270 0.9270 0.9270 1.2567 1.2567 1.2567 1.2567 2.1068 2.1068 2.1068 2.1068 2.3238 2.3238 2.3238 2.3238 2.6965 2.6965 2.6965 2.6965 2.9987 2.9987 2.9987 2.9987 11.8432 11.8432 11.8432 11.8432 15.0423 15.0423 15.0423 15.0423 16.2478 16.2478 k = 0.5000 0.5000 0.6329 ( 2796 PWs) bands (ev): -17.4850 -17.4850 -17.4850 -17.4850 -17.3024 -17.3024 -17.3024 -17.3024 -1.7075 -1.7075 -1.7075 -1.7075 -0.9552 -0.9552 -0.9552 -0.9552 -0.6358 -0.6358 -0.6358 -0.6358 -0.2198 -0.2198 -0.2198 -0.2198 0.5449 0.5449 0.5449 0.5449 0.9254 0.9254 0.9254 0.9254 1.2571 1.2571 1.2571 1.2571 2.1373 2.1373 2.1373 2.1373 2.3197 2.3197 2.3197 2.3197 2.6741 2.6741 2.6741 2.6741 3.0030 3.0030 3.0030 3.0030 11.8567 11.8567 11.8567 11.8567 15.0974 15.0974 15.0974 15.0974 16.2138 16.2138 k = 0.5000 0.5000 0.6476 ( 2796 PWs) bands (ev): -17.4826 -17.4826 -17.4826 -17.4826 -17.3016 -17.3016 -17.3016 -17.3016 -1.7077 -1.7077 -1.7077 -1.7077 -0.9475 -0.9475 -0.9475 -0.9475 -0.6453 -0.6453 -0.6453 -0.6453 -0.2415 -0.2415 -0.2415 -0.2415 0.5490 0.5490 0.5490 0.5490 0.9242 0.9242 0.9242 0.9242 1.2572 1.2572 1.2572 1.2572 2.1670 2.1670 2.1670 2.1670 2.3160 2.3160 2.3160 2.3160 2.6519 2.6519 2.6519 2.6519 3.0067 3.0067 3.0067 3.0067 11.8686 11.8686 11.8686 11.8686 15.1495 15.1495 15.1495 15.1495 16.1838 16.1838 k = 0.5000 0.5000 0.6623 ( 2796 PWs) bands (ev): -17.4805 -17.4805 -17.4805 -17.4805 -17.3009 -17.3009 -17.3009 -17.3009 -1.7081 -1.7081 -1.7081 -1.7081 -0.9402 -0.9402 -0.9402 -0.9402 -0.6533 -0.6533 -0.6533 -0.6533 -0.2611 -0.2611 -0.2611 -0.2611 0.5527 0.5527 0.5527 0.5527 0.9231 0.9231 0.9231 0.9231 1.2572 1.2572 1.2572 1.2572 2.1955 2.1955 2.1955 2.1955 2.3128 2.3128 2.3128 2.3128 2.6301 2.6301 2.6301 2.6301 3.0100 3.0100 3.0100 3.0100 11.8790 11.8790 11.8790 11.8790 15.1979 15.1979 15.1979 15.1979 16.1579 16.1579 k = 0.5000 0.5000 0.6771 ( 2796 PWs) bands (ev): -17.4787 -17.4787 -17.4787 -17.4787 -17.3004 -17.3004 -17.3004 -17.3004 -1.7086 -1.7086 -1.7086 -1.7086 -0.9335 -0.9335 -0.9335 -0.9335 -0.6598 -0.6598 -0.6598 -0.6598 -0.2783 -0.2783 -0.2783 -0.2783 0.5558 0.5558 0.5558 0.5558 0.9223 0.9223 0.9223 0.9223 1.2571 1.2571 1.2571 1.2571 2.2224 2.2224 2.2224 2.2224 2.3101 2.3101 2.3101 2.3101 2.6090 2.6090 2.6090 2.6090 3.0127 3.0127 3.0127 3.0127 11.8878 11.8878 11.8878 11.8878 15.2418 15.2418 15.2418 15.2418 16.1360 16.1360 k = 0.5000 0.5000 0.6918 ( 2788 PWs) bands (ev): -17.4772 -17.4772 -17.4772 -17.4772 -17.2999 -17.2999 -17.2999 -17.2999 -1.7091 -1.7091 -1.7091 -1.7091 -0.9276 -0.9276 -0.9276 -0.9276 -0.6649 -0.6649 -0.6649 -0.6649 -0.2927 -0.2927 -0.2927 -0.2927 0.5584 0.5584 0.5584 0.5584 0.9215 0.9215 0.9215 0.9215 1.2570 1.2570 1.2570 1.2570 2.2470 2.2470 2.2470 2.2470 2.3078 2.3078 2.3078 2.3078 2.5892 2.5892 2.5892 2.5892 3.0149 3.0149 3.0149 3.0149 11.8950 11.8950 11.8950 11.8950 15.2800 15.2800 15.2800 15.2800 16.1180 16.1180 k = 0.5000 0.5000 0.7065 ( 2788 PWs) bands (ev): -17.4761 -17.4761 -17.4761 -17.4761 -17.2995 -17.2995 -17.2995 -17.2995 -1.7096 -1.7096 -1.7096 -1.7096 -0.9227 -0.9227 -0.9227 -0.9227 -0.6689 -0.6689 -0.6689 -0.6689 -0.3044 -0.3044 -0.3044 -0.3044 0.5605 0.5605 0.5605 0.5605 0.9209 0.9209 0.9209 0.9209 1.2568 1.2568 1.2568 1.2568 2.2685 2.2685 2.2685 2.2685 2.3061 2.3061 2.3061 2.3061 2.5715 2.5715 2.5715 2.5715 3.0165 3.0165 3.0165 3.0165 11.9005 11.9005 11.9005 11.9005 15.3115 15.3115 15.3115 15.3115 16.1041 16.1041 k = 0.5000 0.5000 0.7212 ( 2772 PWs) bands (ev): -17.4752 -17.4752 -17.4752 -17.4752 -17.2992 -17.2992 -17.2992 -17.2992 -1.7100 -1.7100 -1.7100 -1.7100 -0.9189 -0.9189 -0.9189 -0.9189 -0.6716 -0.6716 -0.6716 -0.6716 -0.3128 -0.3128 -0.3128 -0.3128 0.5620 0.5620 0.5620 0.5620 0.9206 0.9206 0.9206 0.9206 1.2568 1.2568 1.2568 1.2568 2.2855 2.2855 2.2855 2.2855 2.3050 2.3050 2.3050 2.3050 2.5572 2.5572 2.5572 2.5572 3.0178 3.0178 3.0178 3.0178 11.9045 11.9045 11.9045 11.9045 15.3350 15.3350 15.3350 15.3350 16.0942 16.0942 k = 0.5000 0.5000 0.7359 ( 2776 PWs) bands (ev): -17.4747 -17.4747 -17.4747 -17.4747 -17.2991 -17.2991 -17.2991 -17.2991 -1.7102 -1.7102 -1.7102 -1.7102 -0.9166 -0.9166 -0.9166 -0.9166 -0.6733 -0.6733 -0.6733 -0.6733 -0.3180 -0.3180 -0.3180 -0.3180 0.5628 0.5628 0.5628 0.5628 0.9202 0.9202 0.9202 0.9202 1.2567 1.2567 1.2567 1.2567 2.2962 2.2962 2.2962 2.2962 2.3049 2.3049 2.3049 2.3049 2.5476 2.5476 2.5476 2.5476 3.0185 3.0185 3.0185 3.0185 11.9069 11.9069 11.9069 11.9069 15.3497 15.3497 15.3497 15.3497 16.0882 16.0882 k = 0.5000 0.5000 0.7507 ( 2784 PWs) bands (ev): -17.4746 -17.4746 -17.4746 -17.4746 -17.2990 -17.2990 -17.2990 -17.2990 -1.7103 -1.7103 -1.7103 -1.7103 -0.9159 -0.9159 -0.9159 -0.9159 -0.6739 -0.6739 -0.6739 -0.6739 -0.3197 -0.3197 -0.3197 -0.3197 0.5631 0.5631 0.5631 0.5631 0.9201 0.9201 0.9201 0.9201 1.2566 1.2566 1.2566 1.2566 2.2993 2.2993 2.2993 2.2993 2.3055 2.3055 2.3055 2.3055 2.5442 2.5442 2.5442 2.5442 3.0187 3.0187 3.0187 3.0187 11.9077 11.9077 11.9077 11.9077 15.3546 15.3546 15.3546 15.3546 16.0862 16.0862 Writing output data file ZnF2.save init_run : 0.17s CPU 0.37s WALL ( 1 calls) electrons : 164.10s CPU 167.62s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.05s WALL ( 1 calls) potinit : 0.01s CPU 0.02s WALL ( 1 calls) Called by electrons: c_bands : 164.10s CPU 167.61s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.04s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.05s WALL ( 394 calls) cegterg : 152.94s CPU 155.38s WALL ( 630 calls) Called by sum_band: Called by *egterg: h_psi : 72.37s CPU 73.90s WALL ( 10127 calls) s_psi : 4.17s CPU 4.26s WALL ( 10127 calls) g_psi : 0.18s CPU 0.19s WALL ( 9103 calls) cdiaghg : 69.88s CPU 71.03s WALL ( 9497 calls) cegterg:over : 5.76s CPU 5.85s WALL ( 9103 calls) cegterg:upda : 4.18s CPU 4.07s WALL ( 9103 calls) cegterg:last : 2.79s CPU 2.82s WALL ( 1412 calls) cdiaghg:chol : 3.68s CPU 3.82s WALL ( 9497 calls) cdiaghg:inve : 2.50s CPU 2.64s WALL ( 9497 calls) cdiaghg:para : 4.42s CPU 4.53s WALL ( 18994 calls) Called by h_psi: h_psi:vloc : 62.07s CPU 63.48s WALL ( 10127 calls) h_psi:vnl : 10.13s CPU 10.22s WALL ( 10127 calls) add_vuspsi : 5.18s CPU 5.08s WALL ( 10127 calls) General routines calbec : 4.93s CPU 5.11s WALL ( 10127 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 58.90s CPU 60.12s WALL ( 982800 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.17s CPU 0.22s WALL ( 788 calls) Parallel routines fft_scatter : 24.18s CPU 24.48s WALL ( 982823 calls) PWSCF : 3m 2.25s CPU 3m22.02s WALL This run was terminated on: 18: 2: 0 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=